Table 1. Metadata

format-version

1.2

data-version

0.1.2

date

14:01:2020 10:28

saved-by

julianu

default-namespace

QC

namespace-id-rule

* MS:$sequence(7,0,9999999)$

namespace-id-rule

* QC:$sequence(7,0,9999999)$

remark

coverage: Mass spectrometer quality control metrics

remark

creator: Chris Bielow <chris.bielow ←at→ fu-berlin.de>

remark

creator: Julian Uszkoreit <julian.uszkoreit ←at→ ruhr-uni-bochum.de>

remark

creator: Martin Eisenacher <martin.eisenacher ←at→ ruhr-uni-bochum.de>

remark

creator: Mathias Walzer <walzer ←at→ ebi.ac.uk>

remark

namespace: MS

remark

namespace: QC

import

http://ontologies.berkeleybop.org/uo.obo

import

https://raw.githubusercontent.com/HUPO-PSI/psi-ms-CV/master/psi-ms.obo

import

https://github.com/obi-ontology/obi/blob/master/views/obi.obo

import

https://github.com/ISA-tools/stato/blob/dev/releases/1.4/stato.obo

ontology

qc

2. Definitions and Terms

Table 2. Typedef [has_relation]

id

has_relation

name

has_relation

2.1. has_type has_type

Table 3. Typedef [has_type]

id

has_type

name

has_type

2.2. has_column has_column

Table 4. Typedef [has_column]

id

has_column

name

has_column

2.3. has_optional_column has_optional_column

Table 5. Typedef [has_optional_column]

id

has_optional_column

name

has_optional_column

2.4. has_tuple has_tuple

Table 6. Typedef [has_tuple]

id

has_tuple

name

has_tuple

2.5. has_units has_units

Table 7. Typedef [has_units]

id

has_units

name

has_units

2.6. MS:1009001 quality control metrics generating software

| | null .Term [MS:1009001]

id

MS:1009001

name

quality control metrics generating software

def

"Quality control metrics generating softwares are special types of analysis softwares, which are capable of generating QC metrics." [PSI:PI]

is_a

[MS:1001456] ! analysis software

2.7. MS:1009002 QuaMeter IDFree

Table 8. Term [MS:1009002]

id

MS:1009002

name

QuaMeter IDFree

def

"QuaMeter IDFree is a QC metrics generating software." [PSI:PI]

is_a

MS:1009001 quality control metrics generating software ! quality control metrics generating software

2.8. MS:1009003 iMonDB

Table 9. Term [MS:1009003]

id

MS:1009003

name

iMonDB

def

"iMonDB is a QC metrics generating software." [PSI:PI]

is_a

MS:1009001 quality control metrics generating software ! quality control metrics generating software

2.9. QC:4000001 QC metric

Table 10. Term [QC:4000001]

id

QC:4000001

name

QC metric

def

"Parent term for QC metrics, each metric MUST have this as an ancestor in its is_a relations." [PSI:QC]

2.10. QC:4000002 QC metric value type

Table 11. Term [QC:4000002]

id

QC:4000002

name

QC metric value type

def

"The QC metric type describes what type the respective metric is, like e.g. single value, n-tuple or table" [PSI:QC]

2.11. QC:4000003 single value

Table 12. Term [QC:4000003]

id

QC:4000003

name

single value

def

"Metrics consisting of a single value (in contrast to n-tuple or table). The value must have a unit (e.g. UO:0000221 ! dalton or UO:0000187 ! percent), and optionally a type (e.g. STATO:0000574 ! median, or OBI:0001442 ! q-value)." [PSI:QC]

is_a

QC:4000002 QC metric value type ! QC metric value type

2.12. QC:4000004 n-tuple

Table 13. Term [QC:4000004]

id

QC:4000004

name

n-tuple

def

"Metrics consisting of 'n' values (in contrast to single_value or table), where 'n' is implicitly specified by length of the JSON array, e.g. n=4 for quartiles. All values must be given a unit (e.g. UO:0000221 ! dalton or UO:0000187 ! percent), and optionally a type (e.g. STATO:0000574 ! median, or OBI:0001442 ! q-value). All values in the n-tuple must have the same unit and type (if given)." [PSI:QC]

xref

value-type:xsd\:int "The allowed value-type for this CV term."

is_a

QC:4000002 QC metric value type ! QC metric value type

2.13. QC:4000006 table

Table 14. Term [QC:4000006]

id

QC:4000006

name

table

def

"Metrics consisting of a table or data frame (in contrast to single_value or n-tuple), the values of the table may have different types in each column (in contrast to a matrix). The actual structure of the table is defined in the mzQC specification document. In short: it must have at least one column, and MAY have optional columns. Each column must have a unit (identical for all entries of this column) and may have a value type (e.g. STATO:0000574 ! median, or OBI:0001442 ! q-value)." [PSI:QC]

is_a

QC:4000002 QC metric value type ! QC metric value type

2.14. QC:4000007 matrix

Table 15. Term [QC:4000007]

id

QC:4000007

name

matrix

def

"A matrix is a rectangular array of values of the same type (in contrast to a table). The actual structure of the matrix is defined in the mzQC specification document. In short: All values must be given a unit (e.g. UO:0000221 ! dalton or UO:0000187 ! percent), and optionally a type (e.g. STATO:0000574 ! median, or OBI:0001442 ! q-value). All values in the matrix must have the same unit and type (if given)." [PSI:QC]

is_a

QC:4000002 QC metric value type ! QC metric value type

2.15. QC:4000008 QC metric basis

Table 16. Term [QC:4000008]

id

QC:4000008

name

QC metric basis

def

"The basis for this QC metric, like ID based, ID free, quant based…​" [PSI:QC]

2.16. QC:4000009 ID based

Table 17. Term [QC:4000009]

id

QC:4000009

name

ID based

def

"Metrics based on a previous identification run (in contrast to ID_free, Quant_based)" [PSI:QC]

is_a

QC:4000008 QC metric basis ! QC metric basis

2.17. QC:4000010 ID free

Table 18. Term [QC:4000010]

id

QC:4000010

name

ID free

def

"Metrics not based on a previous identification run (in contrast to ID_based, quant_based)" [PSI:QC]

is_a

QC:4000008 QC metric basis ! QC metric basis

2.18. QC:4000011 quantification based

Table 19. Term [QC:4000011]

id

QC:4000011

name

quantification based

def

"Metrics based on a previous quantification run (in contrast to ID_free, ID_based)" [PSI:QC]

is_a

QC:4000008 QC metric basis ! QC metric basis

2.19. QC:4000012 QC metric relation

Table 20. Term [QC:4000012]

id

QC:4000012

name

QC metric relation

def

"A QC metric describes the basis for the metric calculation like \"one MS run\" or \"one spectrum\"" [PSI:QC]

2.20. QC:4000013 QC metric relation: single run

Table 21. Term [QC:4000013]

id

QC:4000013

name

QC metric relation: single run

def

"Describes a metric that is calculated from a single run (e.g. one .raw file)" [PSI:QC]

is_a

QC:4000012 QC metric relation ! QC metric relation

2.21. QC:4000014 QC metric relation: multiple runs

Table 22. Term [QC:4000014]

id

QC:4000014

name

QC metric relation: multiple runs

def

"A metric which is calculated on multiple runs / a set of runs (e.g. multiple .raw files)" [PSI:QC]

is_a

QC:4000012 QC metric relation ! QC metric relation

2.22. QC:4000015 QC metric relation: one spectrum

Table 23. Term [QC:4000015]

id

QC:4000015

name

QC metric relation: one spectrum

def

"A metric which is calculated on one spectrum" [PSI:QC]

is_a

QC:4000012 QC metric relation ! QC metric relation

2.23. QC:4000016 QC metric relation: multiple spectra

Table 24. Term [QC:4000016]

id

QC:4000016

name

QC metric relation: multiple spectra

def

"A metric which is calculated on multiple spectra" [PSI:QC]

is_a

QC:4000012 QC metric relation ! QC metric relation

2.24. QC:4000020 XIC metric

Table 25. Term [QC:4000020]

id

QC:4000020

name

XIC metric

def

"A metric based on extracted ion chromatograms" [PSI:QC]

is_a

QC:4000022 chromatogram metric ! chromatogram metric

2.25. QC:4000021 retention time metric

Table 26. Term [QC:4000021]

id

QC:4000021

name

retention time metric

def

"A metric based on retention time" [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

2.26. QC:4000022 chromatogram metric

Table 27. Term [QC:4000022]

id

QC:4000022

name

chromatogram metric

def

"A metric based on a chromatogram" [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

2.27. QC:4000023 MS1 metric

Table 28. Term [QC:4000023]

id

QC:4000023

name

MS1 metric

def

"a metric based on MS1 events" [PSI:QC]

is_a

QC:4000028 MS metric ! MS metric

2.28. QC:4000024 MS2 metric

Table 29. Term [QC:4000024]

id

QC:4000024

name

MS2 metric

def

"a metric based on MS2 events" [PSI:QC]

is_a

QC:4000028 MS metric ! MS metric

2.29. QC:4000025 ion source metric

Table 30. Term [QC:4000025]

id

QC:4000025

name

ion source metric

def

"A metric related to events in the ion source" [PSI:QC]

is_a

QC:4000028 MS metric ! MS metric

2.30. QC:4000026 environment metric

Table 31. Term [QC:4000026]

id

QC:4000026

name

environment metric

def

"A metric related to measurements of the environment/laboratory/room." [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

2.31. QC:4000027 sample preparation metric

Table 32. Term [QC:4000027]

id

QC:4000027

name

sample preparation metric

is_a

QC:4000001 QC metric ! QC metric

2.32. QC:4000028 MS metric

Table 33. Term [QC:4000028]

id

QC:4000028

name

MS metric

is_a

QC:4000001 QC metric ! QC metric

2.33. QC:4000050 XIC-WideFrac

Table 34. Term [QC:4000050]

id

QC:4000050

name

XIC-WideFrac

def

"The fraction of precursor ions accounting for the top half of all peak widths" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000020 XIC metric ! XIC metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

2.34. QC:4000051 XIC-FWHM quantiles

Table 35. Term [QC:4000051]

id

QC:4000051

name

XIC-FWHM quantiles

def

"The first to n-th quantile of peak widths for the wide XICs." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000020 XIC metric ! XIC metric

relationship

has_relation [MS:1000086] ! full width at half-maximum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"XIC-FWHM-Q1" RELATED []

synonym

"XIC-FWHM-Q2" RELATED []

synonym

"XIC-FWHM-Q3" RELATED []

2.35. QC:4000052 XIC-Height quantiles ratio to Q1

Table 36. Term [QC:4000052]

id

QC:4000052

name

XIC-Height quantiles ratio to Q1

def

"The log ratio for the second to n-th quantile of wide XIC heights over previous quantile of heights. For the boundary elements min/max are used." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000020 XIC metric ! XIC metric

relationship

has_relation [MS:1000042] ! peak intensity

relationship

has_relation [MS:1000627] ! selected ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"XIC-Height-Q2" RELATED []

synonym

"XIC-Height-Q3" RELATED []

synonym

"XIC-Height-Q4" RELATED []

2.36. QC:4000053 RT duration

Table 37. Term [QC:4000053]

id

QC:4000053

name

RT duration

def

"The retention time duration of the MS run in seconds, similar to the highest scan time minus the lowest scan time." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000021 retention time metric ! retention time metric

relationship

has_relation [MS:1000016] ! scan start time

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"RT-Duration" EXACT []

2.37. QC:4000054 RT over TIC quantile

Table 38. Term [QC:4000054]

id

QC:4000054

name

RT over TIC quantile

def

"The interval when the respective quantile of the TIC accumulates divided by retention time duration. The number of quantiles observed is given by the size of the tuple." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000021 retention time metric ! retention time metric

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"RT-TIC-Q1" RELATED []

synonym

"RT-TIC-Q2" RELATED []

synonym

"RT-TIC-Q3" RELATED []

synonym

"RT-TIC-Q4" RELATED []

property_value

has_units UO:0000191

2.38. QC:4000055 MS1 quantiles RT fraction

Table 39. Term [QC:4000055]

id

QC:4000055

name

MS1 quantiles RT fraction

def

"The interval used for acquisition of the first, second, third, and fourth quarter of all MS1 events divided by RT-Duration." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000021 retention time metric ! retention time metric

is_a

QC:4000023 MS1 metric ! MS1 metric

relationship

has_relation [MS:1000016] ! scan start time

relationship

has_relation [MS:1000579] ! MS1 spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"RT-MS-Q1" RELATED []

synonym

"RT-MS-Q2" RELATED []

synonym

"RT-MS-Q3" RELATED []

synonym

"RT-MS-Q4" RELATED []

property_value

has_units UO:0000191

2.39. QC:4000056 MS2 quantiles RT fraction

Table 40. Term [QC:4000056]

id

QC:4000056

name

MS2 quantiles RT fraction

def

"The interval used for acquisition of the first, second, third, and fourth quarter of all MS2 events divided by RT-Duration." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000021 retention time metric ! retention time metric

is_a

QC:4000024 MS2 metric ! MS2 metric

relationship

has_relation [MS:1000016] ! scan start time

relationship

has_relation [MS:1000580] ! MSn spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_units UO:0000191

synonym

"RT-MSMS-Q1" RELATED []

synonym

"RT-MSMS-Q2" RELATED []

synonym

"RT-MSMS-Q3" RELATED []

synonym

"RT-MSMS-Q4" RELATED []

2.40. QC:4000057 MS1 quantile TIC change ratio to Q1

Table 41. Term [QC:4000057]

id

QC:4000057

name

MS1 quantile TIC change ratio to Q1

def

"The log ratio for the second to n-th quantile of TIC changes over first quantile of TIC changes." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

is_a

QC:4000023 MS1 metric ! MS1 metric

relationship

has_relation [MS:1000016] ! scan start time

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"MS1-TIC-Change-Q2" RELATED []

synonym

"MS1-TIC-Change-Q3" RELATED []

synonym

"MS1-TIC-Change-Q4" RELATED []

2.41. QC:4000058 MS1 quantile TIC ratio to Q1

Table 42. Term [QC:4000058]

id

QC:4000058

name

MS1 quantile TIC ratio to Q1

def

"The log ratio for the second to n-th quantile of TIC over the previous quantile of TIC. For the boundary elements min/max are used." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

is_a

QC:4000023 MS1 metric ! MS1 metric

relationship

has_relation [MS:1000016] ! scan start time

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"MS1-TIC-Q2" RELATED []

synonym

"MS1-TIC-Q3" RELATED []

synonym

"MS1-TIC-Q4" RELATED []

2.42. QC:4000059 Number of MS1 spectra

Table 43. Term [QC:4000059]

id

QC:4000059

name

Number of MS1 spectra

def

"The number of MS1 events in the run." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000023 MS1 metric ! MS1 metric

comment

A lower number of MS1 spectra acquired during one sample run compared to similar runs can indicate mismatched instrument settings or issues with the instrumentation or issues with sample amounts.

relationship

has_relation [MS:1000579] ! MS1 spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_units UO:0000189

synonym

"MS1-Count" EXACT []

2.43. QC:4000060 Number of MS2 spectra

Table 44. Term [QC:4000060]

id

QC:4000060

name

Number of MS2 spectra

def

"The number of MS2 events in the run." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000024 MS2 metric ! MS2 metric

comment

A lower number of MS2 spectra acquired during one sample run compared to similar runs can indicate mismatched instrument settings or issues with the instrumentation or unusual low levels of ions collectable for MS/MS.

relationship

has_relation [MS:1000580] ! MSn spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_units UO:0000189

synonym

"MS2-Count" EXACT []

2.44. QC:4000061 Maximal MS2 frequency

Table 45. Term [QC:4000061]

id

QC:4000061

name

Maximal MS2 frequency

def

"The fastest frequency for MS/MS collection in any minute over the complete run" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000024 MS2 metric ! MS2 metric

relationship

has_relation [MS:1000029] ! sampling frequency

relationship

has_relation [MS:1000580] ! MSn spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_units UO:0000106

synonym

"MS2-Freq-Max" EXACT []

2.45. QC:4000062 MS2 density per quantile

Table 46. Term [QC:4000062]

id

QC:4000062

name

MS2 density per quantile

def

"The first to n-th quantile of MS2 scan peak counts." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000024 MS2 metric ! MS2 metric

relationship

has_relation [MS:1000035] ! peak picking

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

synonym

"MS2-Density-Q1" RELATED []

synonym

"MS2-Density-Q2" RELATED []

synonym

"MS2-Density-Q3" RELATED []

2.46. QC:4000063 MS2 known precursor charges fractions

Table 47. Term [QC:4000063]

id

QC:4000063

name

MS2 known precursor charges fractions

def

"The fraction of MS/MS precursors of the corresponding charge. The fractions [0,1] are given in the 'Fraction' column, corresponding charges in the 'Charge state' column. The highest charge state is to be interpreted as that charge state or higher. " [PSI:QC]

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000024 MS2 metric ! MS2 metric

is_a

QC:4000025 ion source metric ! ion source metric

relationship

has_relation [MS:1000041] ! charge state

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_column: QC:4000238 ! Charge state

property_value

has_column: QC:4000239 ! Fraction

synonym

"MS2-PrecZ-1" RELATED []

synonym

"MS2-PrecZ-2" RELATED []

synonym

"MS2-PrecZ-3" RELATED []

synonym

"MS2-PrecZ-4" RELATED []

synonym

"MS2-PrecZ-5" RELATED []

synonym

"MS2-PrecZ-more" RELATED []

2.47. QC:4000064 MS2 unknown and likely precursor charges fractions

Table 48. Term [QC:4000064]

id

QC:4000064

name

MS2 unknown and likely precursor charges fractions

def

"The fractions of inferred charge state of MS/MS precursors. The fractions [0,1] are given in the 'Fraction' column, corresponding charges in the 'Charge state' column. Charge 0 represents unknown charge states." [PSI:QC]

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000024 MS2 metric ! MS2 metric

is_a

QC:4000025 ion source metric ! ion source metric

is_a

QC:4000006 table ! table

relationship

has_relation [MS:1000041] ! charge state

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_column: QC:4000238 ! Charge state

property_value

has_column: QC:4000239 ! Fraction

synonym

"MS2-PrecZ-likely-1" RELATED []

synonym

"MS2-PrecZ-likely-multi" RELATED []

2.48. QC:4000065 Precursor median m/z for IDs

Table 49. Term [QC:4000065]

id

QC:4000065

name

Precursor median m/z for IDs

def

"Median m/z value for all identified peptides (unique ions) after FDR." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000023 MS1 metric ! MS1 metric

is_a

QC:4000025 ion source metric ! ion source metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

2.49. QC:4000066 Fraction of MS2 identified at different MS1 quantiles

Table 50. Term [QC:4000066]

id

QC:4000066

name

Fraction of MS2 identified at different MS1 quantiles

def

"Fraction of total MS2 scans identified after FDR in the respective quantile of peptides sorted by MS1 maximum intensity." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000023 MS1 metric ! MS1 metric

is_a

QC:4000024 MS2 metric ! MS2 metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

2.50. QC:4000067 Total ion current chromatogram

Table 51. Term [QC:4000067]

id

QC:4000067

name

Total ion current chromatogram

def

"The total ion current chromatogram. The first column contains the retention time values in second, the second column the corresponding relative intensities." [PSI:QC]

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000109 ! Relative intensity

2.51. QC:4000068 Ambient humidity

Table 52. Term [QC:4000068]

id

QC:4000068

name

Ambient humidity

def

"The ambient relative humidity in percent (0,100) over one or more time points. The first column contains is the ambient humidity value(s). The second contains the respective retention time. A negative RT implies that the exact time of measurement is unknown." [PSI:QC]

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000026 environment metric ! environment metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000260 ! Percent

2.52. QC:4000069 MS1 Total ion current chromatogram

Table 53. Term [QC:4000069]

id

QC:4000069

name

MS1 Total ion current chromatogram

def

"The total ion current chromatogram of MS1 measurements. The first column contains the retention time values in seconds, the second column the corresponding relative intensities." [PSI:QC]

comment

The metric enables to check visually e.g. MS1 TIC stability along the retention time and its absolute value compared to MS2 total ion chromatogram or other analyses MS1 TICs. TIC drops caused by e.g. spray stability issues or bubbles presence can be detected here.

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

is_a

QC:4000023 MS1 metric ! MS1 metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

relationship

has_relation QC:4000067 Total ion current chromatogram ! Total ion current chromatogram

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000109 ! Relative intensity

2.53. QC:4000070 MS2 Total ion current chromatogram

Table 54. Term [QC:4000070]

id

QC:4000070

name

MS2 Total ion current chromatogram

def

"The total ion current chromatogram of MS2 measurements. The first column contains the retention time values in second, the second column the corresponding relative intensities." [PSI:QC]

comment

The metric enables to check visually e.g. MS2 TIC absolute value compared to MS1 total ion chromatogram or other analyses MS2 TICs.

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

is_a

QC:4000024 MS2 metric ! MS2 metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: single run

relationship

has_relation QC:4000067 Total ion current chromatogram ! Total ion current chromatogram

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000109 ! Relative intensity

2.54. QC:4000071 Fraction of peptide IDs around max MS1

Table 55. Term [QC:4000071]

id

QC:4000071

name

Fraction of peptide IDs around max MS1

def

"Fraction of all peptides identified at least X minutes earlier or later than the most intense MS1 signal of the identification. The first column contains the time in minute-wise steps of seconds, the other comlumn the fraction of identified. Negative time values indicate minutes before and positive after maximum MS1." [PSI:QC]

comment

Estimates very early peak broadening.

is_a

QC:4000006 table ! table

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000239 ! Fraction

2.55. QC:4000072 Interquartile RT period for peptide identifications

Table 56. Term [QC:4000072]

id

QC:4000072

name

Interquartile RT period for peptide identifications

def

"The interquartile retention time period, in seconds, for all peptide identifications over the complete run." [PSI:QC]

comment

Longer times indicate better chromatographic separation.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.56. QC:4000073 Peptide identification rate of the interquartile RT period

Table 57. Term [QC:4000073]

id

QC:4000073

name

Peptide identification rate of the interquartile RT period

def

"The identification rate of peptides for the interquartile retention time period, in peptides per second." [PSI:QC]

comment

Higher rates indicate efficient sampling and identification.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

relationship

has_relation QC:4000072 Interquartile RT period for peptide identifications ! Interquartile RT period for peptide identifications

2.57. QC:4000074 Median MS1 peak FWHM for peptides

Table 58. Term [QC:4000074]

id

QC:4000074

name

Median MS1 peak FWHM for peptides

def

"Median of all MS1 peak widths at half maximum (FWHM) for all identified peptides, in seconds" [PSI:QC]

comment

Sharper peak widths (i.e. smaller values) indicate better chromatographic resolution.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000086] ! full width at half-maximum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.58. QC:4000075 Interquartile distance of MS1 peak FWHM for identifications

Table 59. Term [QC:4000075]

id

QC:4000075

name

Interquartile distance of MS1 peak FWHM for identifications

def

"Interquartile distance of all MS1 peak widths at half maximum (FWHM) for all identifications, in seconds" [PSI:QC]

comment

Tighter distributions indicate better consistency.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000086] ! full width at half-maximum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.59. QC:4000076 Median MS1 peak FWHM for peptides in RT quantile

Table 60. Term [QC:4000076]

id

QC:4000076

name

Median MS1 peak FWHM for peptides in RT quantile

def

"Median of all MS1 peak widths at half maximum (FWHM) for all identified peptide, in seconds, in the respective identifications' quantiles ordered by retention time. The data is given in a tuple defining the quantiles, 4-tuple represents quartiles, 10-tuple deciles, etc." [PSI:QC]

comment

Sharper peak widths (i.e. smaller values) indicate better chromatographic resolution in the given quantile.

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000086] ! full width at half-maximum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.60. QC:4000077 Area under TIC

Table 61. Term [QC:4000077]

id

QC:4000077

name

Area under TIC

def

"The area under the total ion chromatogram." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.61. QC:4000078 Area under TIC RT quantiles

Table 62. Term [QC:4000078]

id

QC:4000078

name

Area under TIC RT quantiles

def

"The area under the total ion chromatogram of the retention time quantiles. Number of quantiles are given by the n-tuple." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1000235] ! total ion current chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

2.62. QC:4000079 Pump pressure chromatogram

Table 63. Term [QC:4000079]

id

QC:4000079

name

Pump pressure chromatogram

def

"Representation of chromatographic pressure versus time. The first column contains the retention time points in seconds, the second column the corresponding pressures in pascal." [PSI:QC]

is_a

QC:4000006 table ! table

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation [MS:1003019] ! pressure chromatogram

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

property_value

has_column: QC:4000108 ! Retention time

property_value

has_column: QC:4000261 ! Pressure

2.63. QC:4000080 Peptide elution order trailing

Table 64. Term [QC:4000080]

id

QC:4000080

name

Peptide elution order trailing

def

"N(a, b) are the peptides common in the run and a reference run. N(a,b)_i to N(a,b)_j are the first to last eluting common peptides in the run ordered by retention time. This metric is the maximum of ('elution rank' of peptide N(a,b)_t in run) - ('elution_rank' of peptide N(a,b)_t in reference) for the first tenth of common peptides ordered by retention time. The metric is finally normalised with dividing by the number of (identified) peptides in the run." [PSI:QC]

comment

The elution rank difference gives you a measure of how many peptides are eluting early.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation QC:4000014 QC metric relation: multiple runs ! QC metric relation: multiple runs

2.64. QC:4000081 Peptide elution order preceding

Table 65. Term [QC:4000081]

id

QC:4000081

name

Peptide elution order preceding

def

"N(a, b) are the peptides common in the run and a reference run. N(a,b)_i to N(a,b)_j are the first to last eluting common peptides in the run ordered by retention time. This metric is the maximum of ('elution rank' of peptide N(a,b)_t in run) - ('elution_rank' of peptide N(a,b)_t in reference) for the last tenth of common peptides ordered by retention time. The metric is finally normalised with dividing by the number of (identified) peptides in the run." [PSI:QC]

comment

The elution rank difference gives you a measure of how many peptides are eluting late.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000022 chromatogram metric ! chromatogram metric

relationship

has_relation QC:4000014 QC metric relation: multiple runs ! QC metric relation: multiple runs

2.65. QC:4000107 Column type

Table 66. Term [QC:4000107]

id

QC:4000107

name

Column type

def

"The parent to the group of column definitions for name, content, and units for table type." [PSI:QC]

relationship

has_relation QC:4000006 table ! table

2.66. QC:4000108 Retention time

Table 67. Term [QC:4000108]

id

QC:4000108

name

Retention time

def

"The column contains retention time points in seconds." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000010

2.67. QC:4000109 Relative intensity

Table 68. Term [QC:4000109]

id

QC:4000109

name

Relative intensity

def

"The column contains relative intensity values of one type." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units MS:1000043

2.68. QC:4000110 Sequence coverage

Table 69. Term [QC:4000110]

id

QC:4000110

name

Sequence coverage

def

"The column contains sequence coverage values in percent, e.g. from proteins." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000187

property_value

has_type NCIT:C68811

2.69. QC:4000111 Protein accession

Table 70. Term [QC:4000111]

id

QC:4000111

name

Protein accession

def

"The column contains protein accessions." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_types MS:1000885

2.70. QC:4000112 Length value

Table 71. Term [QC:4000112]

id

QC:4000112

name

Length value

def

"The column contains length values of sequences, i.e. the count of items within the sequences, e.g. total length of proteins." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000189

2.71. QC:4000113 Target or decoy designation

Table 72. Term [QC:4000113]

id

QC:4000113

name

Target or decoy designation

def

"The column contains designations of the type 'target', 'decoy', or 'target+decoy'." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_types NCIT:C45253

2.72. QC:4000114 Sample rate

Table 73. Term [QC:4000114]

id

QC:4000114

name

Sample rate

def

"The column contains sample rate values as number of occurrences." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units PATO:0000161

2.73. QC:4000115 Count

Table 74. Term [QC:4000115]

id

QC:4000115

name

Count

def

"The column contains counts of occurrences of a common type." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000189

2.74. QC:4000116 Peptide sequence

Table 75. Term [QC:4000116]

id

QC:4000116

name

Peptide sequence

def

"The column contains peptide sequences; multiple peptides are separated by space." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_types NCIT:C45253

2.75. QC:4000117 Outliers below

Table 76. Term [QC:4000117]

id

QC:4000117

name

Outliers below

def

"The outlier values below 1.5 * IQR." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type NCIT:C79083

2.76. QC:4000118 Outliers above

Table 77. Term [QC:4000118]

id

QC:4000118

name

Outliers above

def

"The outlier values above 1.5 * IQR." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type NCIT:C79083

2.77. QC:4000119 Protein coverage

Table 78. Term [QC:4000119]

id

QC:4000119

name

Protein coverage

def

"The coverage of protein sequences from the peptide sequences identified. The table records the coverage itself (in percent), the protein accession (SHOULD correspond to the accession used in fasta document used for Sequence DB based identification), Length of the protein(, and optionally if it is 'target' or 'decoy' entry.)" [PSI:QC]

comment

The protein coverage can provide insight into the sensitivity of the instrument/identification/protocols used.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column QC:4000110

property_value

has_column QC:4000111

property_value

has_column QC:4000112

property_value

has_optional_column QC:4000113

2.78. QC:4000120 Sampling rates

Table 79. Term [QC:4000120]

id

QC:4000120

name

Sampling rates

def

"The sampling rates of identified peptides and their respective frequency (accumulated by the sampling rate, i.e. how often peptides were sampled n times and how many peptides were resampled at that rate. Optionally, which peptides were sampled at that rate, space separated)" [PSI:QC]

comment

The sampling rate may give insights to peptide separation, dynamic exclusion settings and gradient efficiency.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column QC:4000114

property_value

has_column QC:4000115

property_value

has_optional_column QC:4000116

2.79. QC:4000121 Explained precursor intensity first quarter

Table 80. Term [QC:4000121]

id

QC:4000121

name

Explained precursor intensity first quarter

def

"Fraction of identified MS2 in the first quarter of MS2 sorted by precursor intensity." [PSI:QC]

comment

Higher fractions of identified MS2 spectra indicate the efficiency of detection and sampling

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"MS2-4A" NARROW []

2.80. QC:4000122 Explained precursor intensity second quarter

Table 81. Term [QC:4000122]

id

QC:4000122

name

Explained precursor intensity second quarter

def

"Fraction of identified MS2 in the second quarter of MS2 sorted by precursor intensity." [PSI:QC]

comment

Higher fractions of identified MS2 spectra indicate the efficiency of detection and sampling

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"MS2-4B" NARROW []

2.81. QC:4000123 Explained precursor intensity third quarter

Table 82. Term [QC:4000123]

id

QC:4000123

name

Explained precursor intensity third quarter

def

"Fraction of identified MS2 in the third quarter of MS2 sorted by precursor intensity." [PSI:QC]

comment

Higher fractions of identified MS2 spectra indicate the efficiency of detection and sampling

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"MS2-4C" NARROW []

2.82. QC:4000124 Explained precursor intensity fourth quarter

Table 83. Term [QC:4000124]

id

QC:4000124

name

Explained precursor intensity fourth quarter

def

"Fraction of identified MS2 in the fourth quarter of MS2 sorted by precursor intensity." [PSI:QC]

comment

Higher fractions of identified MS2 spectra indicate the efficiency of detection and sampling

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"MS2-4D" NARROW []

2.83. QC:4000125 Extent of identified precursor intensity

Table 84. Term [QC:4000125]

id

QC:4000125

name

Extent of identified precursor intensity

def

"Ratio of 95th over 5th percentile of precursor intensity for identified peptides" [PSI:QC]

comment

Can be used to approximate the dynamic range of signal

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000300

synonym

"MS1-3A" NARROW []

2.84. QC:4000126 Precursor intensity range of identified MS2

Table 85. Term [QC:4000126]

id

QC:4000126

name

Precursor intensity range of identified MS2

def

"Minimum and maximum precursor intensity recorded and identified." [PSI:QC]

comment

The intensity range of the identified precursors informs about the dynamic range of the acquisition.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units MS:1003085

2.85. QC:4000127 Precursor intensity of identified MS2 Q1, Q2, Q3

Table 86. Term [QC:4000127]

id

QC:4000127

name

Precursor intensity of identified MS2 Q1, Q2, Q3

def

"From the distribution of precursor intensity of identified MS2, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The (un)identified precursor intensity distribution can aid the interpretation of overall identification success.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.86. QC:4000128 Precursor intensity of unidentified MS2 Q1, Q2, Q3

Table 87. Term [QC:4000128]

id

QC:4000128

name

Precursor intensity of unidentified MS2 Q1, Q2, Q3

def

"From the distribution of precursor intensity of unidentified MS2, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The (un)identified precursor intensity distribution can aid the interpretation of overall identification success.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.87. QC:4000129 Median S/N for MS1 spectra in RT range in which half of the identified spectra are identified

Table 88. Term [QC:4000129]

id

QC:4000129

name

Median S/N for MS1 spectra in RT range in which half of the identified spectra are identified

def

"Median S/N for MS1 spectra whose RT is between Q1-Q3 of identified MS2 spectra. This will be half of the identified MS2 spectra." [PSI:QC]

comment

Higher MS1 S/N may correlate with higher signal discrimination

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000300

synonym

"MS1-2A" NARROW []

2.88. QC:4000130 Median of TIC values in the RT range in which the middle half of peptides are identified

Table 89. Term [QC:4000130]

id

QC:4000130

name

Median of TIC values in the RT range in which the middle half of peptides are identified

def

"Median of TIC values in the RT range in which half of peptides are identified (RT values of Q1 to Q3 of identifications)" [PSI:QC]

comment

Estimates the total absolute signal for peptides (may vary significantly between instruments)

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"MS1-2B" NARROW []

2.89. QC:4000131 Median S/N for MS1 spectra in the shortest RT range in which half of the peptides are identified

Table 90. Term [QC:4000131]

id

QC:4000131

name

Median S/N for MS1 spectra in the shortest RT range in which half of the peptides are identified

def

"Median S/N for MS1 spectra in the shortest RT range in which half of the peptides are identified" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

2.90. QC:4000132 Median of TIC values in the shortest RT range in which half of the peptides are identified

Table 91. Term [QC:4000132]

id

QC:4000132

name

Median of TIC values in the shortest RT range in which half of the peptides are identified

def

"Median of TIC values in the shortest RT range in which half of the peptides are identified" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

2.91. QC:4000133 Explained base peak intensity median

Table 92. Term [QC:4000133]

id

QC:4000133

name

Explained base peak intensity median

def

"Median of the ratio of 'max survey scan intensity' over 'sampled precursor intensity' for all peptides identified" [PSI:QC]

comment

Gives insight into the amount of overall explained signal and whether the amount of signal could be increased by a better sampling strategy.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000574

2.92. QC:4000134 Explained base peak intensity median from least intense 50% base peaks

Table 93. Term [QC:4000134]

id

QC:4000134

name

Explained base peak intensity median from least intense 50% base peaks

def

"Ratios of 'max survey scan intensity' over sampled precursor intensity for the bottom half (by MS1 max) of MS2" [PSI:QC]

comment

Gives insight into the amount of explained signal and whether the sampling strategy is interfering with the sampling of low abundant peaks.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

2.93. QC:4000135 Number of chromatograms

Table 94. Term [QC:4000135]

id

QC:4000135

name

Number of chromatograms

def

"Number of chromatograms" [PSI:QC]

comment

A lower number of chromatograms acquired during one sample run compared to similar runs can indicate mismatched instrument settings or issues with the instrumentation.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.94. QC:4000138 MZ acquisition range

Table 95. Term [QC:4000138]

id

QC:4000138

name

MZ acquisition range

def

"Upper and lower limit of m/z values at which spectra are recorded." [PSI:QC]

comment

Acquisition levels can be used as a criterion to assess the comparability of instrument settings between runs.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units MS:1000040

2.95. QC:4000139 RT acquisition range

Table 96. Term [QC:4000139]

id

QC:4000139

name

RT acquisition range

def

"Upper and lower limit of time at which spectra are recorded." [PSI:QC]

comment

Acquisition levels can be used as a criterion to assess the comparability of instrument settings between runs.

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units UO:0000010

2.96. QC:4000140 Fastest frequency for MS level 1 collection

Table 97. Term [QC:4000140]

id

QC:4000140

name

Fastest frequency for MS level 1 collection

def

"Fastest frequency for MS level 1 collection" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000106

2.97. QC:4000141 Fastest frequency for MS level 2 collection

Table 98. Term [QC:4000141]

id

QC:4000141

name

Fastest frequency for MS level 2 collection

def

"Fastest frequency for MS level 2 collection" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000106

2.98. QC:4000142 Slowest frequency for MS level 1 collection

Table 99. Term [QC:4000142]

id

QC:4000142

name

Slowest frequency for MS level 1 collection

def

"Slowest frequency for MS level 1 collection" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000106

2.99. QC:4000143 Slowest frequency for MS level 2 collection

Table 100. Term [QC:4000143]

id

QC:4000143

name

Slowest frequency for MS level 2 collection

def

"Slowest frequency for MS level 2 collection" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000106

2.100. QC:4000144 Precursor intensity range

Table 101. Term [QC:4000144]

id

QC:4000144

name

Precursor intensity range

def

"Minimum and maximum precursor intensity recorded." [PSI:QC]

comment

The intensity range of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units MS:1003085

2.101. QC:4000145 MS1 frequency in RT quarters

Table 102. Term [QC:4000145]

id

QC:4000145

name

MS1 frequency in RT quarters

def

"MS1 frequency in RT 1st quarter, 2nd quarter, 3rd quarter, 4th quarter" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units UO:0000106

2.102. QC:4000146 MS2 frequency in RT quarters

Table 103. Term [QC:4000146]

id

QC:4000146

name

MS2 frequency in RT quarters

def

"MS2 frequency in RT 1st quarter, 2nd quarter, 3rd quarter, 4th quarter" [PSI:QC]

comment

Spectrum acquisition frequency can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units UO:0000106

2.103. QC:4000147 MS1 ion collection time Q1, Q2, Q3

Table 104. Term [QC:4000147]

id

QC:4000147

name

MS1 ion collection time Q1, Q2, Q3

def

"From the distribution of ion injection times (MS:1000927) for MS1, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.104. QC:4000148 MS1 ion collection time mean

Table 105. Term [QC:4000148]

id

QC:4000148

name

MS1 ion collection time mean

def

"From the distribution of ion injection times (MS:1000927) for MS1, the mean" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.105. QC:4000149 MS1 ion collection time sigma

Table 106. Term [QC:4000149]

id

QC:4000149

name

MS1 ion collection time sigma

def

"From the distribution of ion injection times (MS:1000927) for MS1, the sigma value" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.106. QC:4000150 MS1 ion collection time low outliers (<Q1-1.5*IQR)

Table 107. Term [QC:4000150]

id

QC:4000150

name

MS1 ion collection time low outliers (<Q1-1.5*IQR)

def

"From the distribution of ion injection times (MS:1000927) for MS1, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.107. QC:4000151 MS1 ion collection time high outliers (>Q3+1.5*IQR)

Table 108. Term [QC:4000151]

id

QC:4000151

name

MS1 ion collection time high outliers (>Q3+1.5*IQR)

def

"From the distribution of ion injection times (MS:1000927) for MS1, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.108. QC:4000152 MS2 ion collection time Q1, Q2, Q3

Table 109. Term [QC:4000152]

id

QC:4000152

name

MS2 ion collection time Q1, Q2, Q3

def

"From the distribution of ion injection times (MS:1000927) for MS2, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.109. QC:4000153 MS2 ion collection time mean

Table 110. Term [QC:4000153]

id

QC:4000153

name

MS2 ion collection time mean

def

"From the distribution of ion injection times (MS:1000927) for MS2, the mean" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.110. QC:4000154 MS2 ion collection time sigma

Table 111. Term [QC:4000154]

id

QC:4000154

name

MS2 ion collection time sigma

def

"From the distribution of ion injection times (MS:1000927) for MS2, the sigma value" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.111. QC:4000155 MS2 ion collection time low outliers (<Q1-1.5*IQR)

Table 112. Term [QC:4000155]

id

QC:4000155

name

MS2 ion collection time low outliers (<Q1-1.5*IQR)

def

"From the distribution of ion injection times (MS:1000927) for MS2, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.112. QC:4000156 MS2 ion collection time high outliers (>Q3+1.5*IQR)

Table 113. Term [QC:4000156]

id

QC:4000156

name

MS2 ion collection time high outliers (>Q3+1.5*IQR)

def

"From the distribution of ion injection times (MS:1000927) for MS2, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

Injection time distribution can be used to gauge the suitability of used instrument settings for the sample content used.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.113. QC:4000157 Peak density distribution MS1 Q1, Q2, Q3

Table 114. Term [QC:4000157]

id

QC:4000157

name

Peak density distribution MS1 Q1, Q2, Q3

def

"From the distribution of peak densities in MS1, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The distribution of peak densities in MS1 can provide insight into the presence of nuisance factors.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.114. QC:4000158 Peak density distribution MS1 mean

Table 115. Term [QC:4000158]

id

QC:4000158

name

Peak density distribution MS1 mean

def

"From the distribution of peak densities in MS1, the mean" [PSI:QC]

comment

The distribution of peak densities in MS1 can provide insight into the presence of nuisance factors.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.115. QC:4000159 Peak density distribution MS1 sigma

Table 116. Term [QC:4000159]

id

QC:4000159

name

Peak density distribution MS1 sigma

def

"From the distribution of peak densities in MS1, the sigma value" [PSI:QC]

comment

The distribution of peak densities in MS1 can provide insight into the presence of nuisance factors.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.116. QC:4000160 Peak density distribution MS1 low outliers (<Q1-1.5*IQR)

Table 117. Term [QC:4000160]

id

QC:4000160

name

Peak density distribution MS1 low outliers (<Q1-1.5*IQR)

def

"From the distribution of peak densities in MS1, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

The distribution of peak densities in MS1 can provide insight into the presence of nuisance factors.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.117. QC:4000161 Peak density distribution MS1 high outliers (>Q3+1.5*IQR)

Table 118. Term [QC:4000161]

id

QC:4000161

name

Peak density distribution MS1 high outliers (>Q3+1.5*IQR)

def

"From the distribution of peak densities in MS1, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

The distribution of peak densities in MS1 can provide insight into the presence of nuisance factors.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.118. QC:4000162 Peak density distribution MS2 Q1, Q2, Q3

Table 119. Term [QC:4000162]

id

QC:4000162

name

Peak density distribution MS2 Q1, Q2, Q3

def

"From the distribution of peak densities in MS2, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The distribution of peak densities in MS2 can provide insight into the instruments ion selction settings.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_type STATO:0000167

property_value

has_type STATO:0000574

property_value

has_type STATO:0000170

2.119. QC:4000163 Peak density distribution MS2 mean

Table 120. Term [QC:4000163]

id

QC:4000163

name

Peak density distribution MS2 mean

def

"From the distribution of peak densities in MS2, the mean" [PSI:QC]

comment

The distribution of peak densities in MS2 can provide insight into the instruments ion selction settings.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.120. QC:4000164 Peak density distribution MS2 sigma

Table 121. Term [QC:4000164]

id

QC:4000164

name

Peak density distribution MS2 sigma

def

"From the distribution of peak densities in MS2, the sigma value" [PSI:QC]

comment

The distribution of peak densities in MS2 can provide insight into the instruments ion selction settings.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.121. QC:4000165 Peak density distribution MS2 low outliers (<Q1-1.5*IQR)

Table 122. Term [QC:4000165]

id

QC:4000165

name

Peak density distribution MS2 low outliers (<Q1-1.5*IQR)

def

"From the distribution of peak densities in MS2, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

The distribution of peak densities in MS2 can provide insight into the instruments ion selction settings.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.122. QC:4000166 Peak density distribution MS2 high outliers (>Q3+1.5*IQR)

Table 123. Term [QC:4000166]

id

QC:4000166

name

Peak density distribution MS2 high outliers (>Q3+1.5*IQR)

def

"From the distribution of peak densities in MS2, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

The distribution of peak densities in MS2 can provide insight into the instruments ion selction settings.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.123. QC:4000167 Precursor intensity distribution Q1, Q2, Q3

Table 124. Term [QC:4000167]

id

QC:4000167

name

Precursor intensity distribution Q1, Q2, Q3

def

"From the distribution of precursor intensities, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The intensity distribution of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.124. QC:4000168 Precursor intensity distribution mean

Table 125. Term [QC:4000168]

id

QC:4000168

name

Precursor intensity distribution mean

def

"From the distribution of precursor intensities, the mean" [PSI:QC]

comment

The intensity distribution of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.125. QC:4000169 Precursor intensity distribution sigma

Table 126. Term [QC:4000169]

id

QC:4000169

name

Precursor intensity distribution sigma

def

"From the distribution of precursor intensities, the sigma value" [PSI:QC]

comment

The intensity distribution of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.126. QC:4000170 Precursor intensity distribution low outliers (<Q1-1.5*IQR)

Table 127. Term [QC:4000170]

id

QC:4000170

name

Precursor intensity distribution low outliers (<Q1-1.5*IQR)

def

"From the distribution of precursor intensities, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

The intensity distribution of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.127. QC:4000171 Precursor intensity distribution high outliers (>Q3+1.5*IQR)

Table 128. Term [QC:4000171]

id

QC:4000171

name

Precursor intensity distribution high outliers (>Q3+1.5*IQR)

def

"From the distribution of precursor intensities, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

The intensity distribution of the precursors informs about the dynamic range of the acquisition.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.128. QC:4000172 MS1 signal jump (10x) count

Table 129. Term [QC:4000172]

id

QC:4000172

name

MS1 signal jump (10x) count

def

"The count of MS1 signal jump (spectra sum) by a factor of ten or more (10x) between two subsequent scans" [PSI:QC]

comment

An unusual high count of signal jumps or falls can indicate ESI stability issues.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-1A" RELATED []

2.129. QC:4000173 MS1 signal fall (10x) count

Table 130. Term [QC:4000173]

id

QC:4000173

name

MS1 signal fall (10x) count

def

"The count of MS1 signal decline (spectra sum) by a factor of ten or more (10x) between two subsequent scans" [PSI:QC]

comment

An unusual high count of signal jumps or falls can indicate ESI stability issues.

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-1B" RELATED []

2.130. QC:4000174 Charged peptides ratio 1+ over 2+

Table 131. Term [QC:4000174]

id

QC:4000174

name

Charged peptides ratio 1+ over 2+

def

"Ratio of 1+ peptide count over 2+ peptide count in identified spectra" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3A" NARROW []

2.131. QC:4000175 Charged peptides ratio 3+ over 2+

Table 132. Term [QC:4000175]

id

QC:4000175

name

Charged peptides ratio 3+ over 2+

def

"Ratio of 3+ peptide count over 2+ peptide count in identified spectra" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3B" NARROW []

2.132. QC:4000176 Charged peptides ratio 4+ over 2+

Table 133. Term [QC:4000176]

id

QC:4000176

name

Charged peptides ratio 4+ over 2+

def

"Ratio of 4+ peptide count over 2+ peptide count in identified spectra" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3C" NARROW []

2.133. QC:4000177 Mean charge in identified spectra

Table 134. Term [QC:4000177]

id

QC:4000177

name

Mean charge in identified spectra

def

"Mean charge in identified spectra" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

2.134. QC:4000178 Median charge in identified spectra

Table 135. Term [QC:4000178]

id

QC:4000178

name

Median charge in identified spectra

def

"Median charge in identified spectra" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

2.135. QC:4000179 Charged spectra ratio +1 over +2

Table 136. Term [QC:4000179]

id

QC:4000179

name

Charged spectra ratio +1 over +2

def

"Ratio of 1+ spectra count over 2+ spectra count in all MS2" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3A" RELATED []

2.136. QC:4000180 Charged spectra ratio +3 over +2

Table 137. Term [QC:4000180]

id

QC:4000180

name

Charged spectra ratio +3 over +2

def

"Ratio of 3+ peptide count over 2+ peptide count in all MS2" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3B" RELATED []

2.137. QC:4000181 Charged spectra ratio +4 over +2

Table 138. Term [QC:4000181]

id

QC:4000181

name

Charged spectra ratio +4 over +2

def

"Ratio of 4+ peptide count over 2+ peptide count in all MS2" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

synonym

"IS-3C" RELATED []

2.138. QC:4000182 Mean precursor charge in all MS2

Table 139. Term [QC:4000182]

id

QC:4000182

name

Mean precursor charge in all MS2

def

"Mean precursor charge in all MS2" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

2.139. QC:4000183 Median precursor charge in all MS2

Table 140. Term [QC:4000183]

id

QC:4000183

name

Median precursor charge in all MS2

def

"Median precursor charge in all MS2" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

2.140. QC:4000184 Number of different distinct proteins from all PSM

Table 141. Term [QC:4000184]

id

QC:4000184

name

Number of different distinct proteins from all PSM

def

"Number of different distinct protein from all PSM after FDR filtering. (No undistinguishability groups.)" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.141. QC:4000185 Number of identified proteins

Table 142. Term [QC:4000185]

id

QC:4000185

name

Number of identified proteins

def

"Number of identified proteins at given FDR threshold, first number is the number of proteins (considering sequence only), second number is the FDR threshold applied (negative if no threshold applied)" [PSI:QC]

comment

The number of identifications are likely to only make local sense within a confined set of identification parameters (identification algorithm, searchspace, FDR method).

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.142. QC:4000186 Total number of PSM

Table 143. Term [QC:4000186]

id

QC:4000186

name

Total number of PSM

def

"Total number of PSM before FDR filtering." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.143. QC:4000187 Number of identified peptides

Table 144. Term [QC:4000187]

id

QC:4000187

name

Number of identified peptides

def

"Number of identified peptides at given FDR threshold, first number is the number of peptides (considering sequence only), second number is the FDR threshold applied (negative if no threshold applied)" [PSI:QC]

comment

The number of identifications are likely to only make local sense within a confined set of identification parameters (identification algorithm, searchspace, FDR method).

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.144. QC:4000188 Number of identified spectra

Table 145. Term [QC:4000188]

id

QC:4000188

name

Number of identified spectra

def

"Number of identified spectra at given FDR threshold, first number is the number of spectra, second number is the FDR threshold applied (negative if no threshold applied)" [PSI:QC]

comment

The number of identifications are likely to only make local sense within a confined set of identification parameters (identification algorithm, searchspace, FDR method).

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.145. QC:4000189 ID ratio

Table 146. Term [QC:4000189]

id

QC:4000189

name

ID ratio

def

"The ratio of identified and recorded MS2 spectra after FDR filtering." [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000300

2.146. QC:4000190 Precursor errors (Da) Q1, Q2, Q3

Table 147. Term [QC:4000190]

id

QC:4000190

name

Precursor errors (Da) Q1, Q2, Q3

def

"From the distribution of Precursor errors (mass deviation of precursor to identified peptide in Da), the quartiles Q1, Q2, Q3 value" [PSI:QC]

comment

The absolute precursor error distribution can aid the interpretation of overall identification success.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.147. QC:4000191 Precursor errors (Da) mean

Table 148. Term [QC:4000191]

id

QC:4000191

name

Precursor errors (Da) mean

comment

The absolute precursor error distribution can aid the interpretation of overall identification success.

def

"From the distribution of Precursor errors (mass deviation of precursor to identified peptide in Da), the mean" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

synonym

"MS1-5B" NARROW []

2.148. QC:4000192 Precursor errors (Da) sigma

Table 149. Term [QC:4000192]

id

QC:4000192

name

Precursor errors (Da) sigma

def

"From the distribution of Precursor errors (mass deviation of precursor to identified peptide in Da), the sigma value" [PSI:QC]

comment

The absolute precursor error distribution can aid the interpretation of overall identification success.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.149. QC:4000193 Precursor errors (Da) outliers (<Q1-1.5*IQR)

Table 150. Term [QC:4000193]

id

QC:4000193

name

Precursor errors (Da) outliers (<Q1-1.5*IQR)

def

"From the distribution of Precursor errors (mass deviation of precursor to identified peptide in Da), the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The absolute precursor error distribution can aid the interpretation of overall identification success.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column QC:4000117

2.150. QC:4000194 Precursor errors (Da) outliers (>Q3+1.5*IQR)

Table 151. Term [QC:4000194]

id

QC:4000194

name

Precursor errors (Da) outliers (>Q3+1.5*IQR)

def

"From the distribution of Precursor errors (mass deviation of precursor to identified peptide in Da), the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The absolute precursor error distribution can aid the interpretation of overall identification success.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column QC:4000118

2.151. QC:4000195 Precursor errors (ppm) Q1, Q2, Q3

Table 152. Term [QC:4000195]

id

QC:4000195

name

Precursor errors (ppm) Q1, Q2, Q3

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

def

"From the distribution of Precursor errors (ppm), the quartiles Q1, Q2, Q3 value" [PSI:QC]

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.152. QC:4000196 Precursor errors (ppm) mean

Table 153. Term [QC:4000196]

id

QC:4000196

name

Precursor errors (ppm) mean

def

"From the distribution of Precursor errors (ppm), the mean " [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000401

2.153. QC:4000197 Precursor errors (ppm) sigma

Table 154. Term [QC:4000197]

id

QC:4000197

name

Precursor errors (ppm) sigma

def

"From the distribution of Precursor errors (ppm), the sigma value" [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000237

2.154. QC:4000198 Precursor errors (ppm) low outliers (<Q1-1.5*IQR)

Table 155. Term [QC:4000198]

id

QC:4000198

name

Precursor errors (ppm) low outliers (<Q1-1.5*IQR)

def

"From the distribution of Precursor errors (ppm), the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.155. QC:4000199 Precursor errors (ppm) outliers (>Q3+1.5*IQR)

Table 156. Term [QC:4000199]

id

QC:4000199

name

Precursor errors (ppm) outliers (>Q3+1.5*IQR)

def

"From the distribution of Precursor errors (ppm), the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.156. QC:4000200 Precursor errors (Da) median

Table 157. Term [QC:4000200]

id

QC:4000200

name

Precursor errors (Da) median

def

"From the distribution of Precursor errors (Da), the median" [PSI:QC]

comment

The precursor error distribution can aid the interpretation of overall identification success.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

synonym

"MS1-5A" NARROW []

2.157. QC:4000201 Precursor errors (ppm) median

Table 158. Term [QC:4000201]

id

QC:4000201

name

Precursor errors (ppm) median

def

"From the distribution of Precursor errors (ppm), the median" [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

synonym

"MS1-5C" NARROW []

2.158. QC:4000202 Precursor errors (ppm) IQR

Table 159. Term [QC:4000202]

id

QC:4000202

name

Precursor errors (ppm) IQR

def

"From the distribution of Precursor errors (ppm), the IQR" [PSI:QC]

comment

The precursor error in ppm distribution can aid the interpretation of overall identification success.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

synonym

"MS1-5D" NARROW []

2.159. QC:4000203 Identification score - Q1, Q2, Q3

Table 160. Term [QC:4000203]

id

QC:4000203

name

Identification score - Q1, Q2, Q3

def

"From the distribution of Identification score, the Q1, Q2, Q3 value" [PSI:QC]

comment

The identification score distribution can help improve scoring function tuning, aid the interpretation of overall identification success, and integration with downstream processing such as percolator. Comparisons will likely only make local sense where the same method of identification is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.160. QC:4000204 Identification score - mean

Table 161. Term [QC:4000204]

id

QC:4000204

name

Identification score - mean

def

"From the distribution of Identification score, the mean value" [PSI:QC]

comment

The identification score distribution can help improve scoring function tuning, aid the interpretation of overall identification success, and integration with downstream processing such as percolator. Comparisons will likely only make local sense where the same method of identification is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000401

2.161. QC:4000205 Identification score - sigma

Table 162. Term [QC:4000205]

id

QC:4000205

name

Identification score - sigma

def

"From the distribution of Identification score, the sigma value" [PSI:QC]

comment

The identification score distribution can help improve scoring function tuning, aid the interpretation of overall identification success, and integration with downstream processing such as percolator. Comparisons will likely only make local sense where the same method of identification is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.162. QC:4000206 Identification score - low outliers (<Q1-1.5*IQR)

Table 163. Term [QC:4000206]

id

QC:4000206

name

Identification score - low outliers (<Q1-1.5*IQR)

def

"From the distribution of Identification score, the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The identification score distribution can help improve scoring function tuning, aid the interpretation of overall identification success, and integration with downstream processing such as percolator. Comparisons will likely only make local sense where the same method of identification is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.163. QC:4000207 Identification score - high outliers (>Q3+1.5*IQR)

Table 164. Term [QC:4000207]

id

QC:4000207

name

Identification score - high outliers (>Q3+1.5*IQR)

def

"From the distribution of Identification score, the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The identification score distribution can help improve scoring function tuning, aid the interpretation of overall identification success, and integration with downstream processing such as percolator. Comparisons will likely only make local sense where the same method of identification is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.164. QC:4000208 Missed cleavages - Q1, Q2, Q3

Table 165. Term [QC:4000208]

id

QC:4000208

name

Missed cleavages - Q1, Q2, Q3

def

"From the distribution of missed cleavages in identified peptides the quartiles Q1, Q2, Q3 value" [PSI:QC]

comment

The missed cleavage distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.165. QC:4000209 Missed cleavages - mean

Table 166. Term [QC:4000209]

id

QC:4000209

name

Missed cleavages - mean

def

"From the distribution of missed cleavages in identified peptides the mean" [PSI:QC]

comment

The missed cleavage distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000401

synonym

"MS1-5B" NARROW []

2.166. QC:4000210 Missed cleavages - sigma

Table 167. Term [QC:4000210]

id

QC:4000210

name

Missed cleavages - sigma

def

"From the distribution of missed cleavages in identified peptides the sigma value" [PSI:QC]

comment

The missed cleavage distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000237

2.167. QC:4000211 Missed cleavages - low outliers (<Q1-1.5*IQR)

Table 168. Term [QC:4000211]

id

QC:4000211

name

Missed cleavages - low outliers (<Q1-1.5*IQR)

def

"From the distribution of missed cleavages in identified peptides, the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The missed cleavage distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.168. QC:4000212 Missed cleavages - high outliers (>Q3+1.5*IQR)

Table 169. Term [QC:4000212]

id

QC:4000212

name

Missed cleavages - high outliers (>Q3+1.5*IQR)

def

"From the distribution of missed cleavages in identified peptides, the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The missed cleavage distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.169. QC:4000213 Identified peptide lengths - Q1, Q2, Q3

Table 170. Term [QC:4000213]

id

QC:4000213

name

Identified peptide lengths - Q1, Q2, Q3

def

"From the distribution of identified peptide lengths the quartiles Q1, Q2, Q3 value" [PSI:QC]

comment

The identified peptide lengths distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.170. QC:4000214 Identified peptide lengths - mean

Table 171. Term [QC:4000214]

id

QC:4000214

name

Identified peptide lengths - mean

def

"From the distribution of identified peptide lengths the mean" [PSI:QC]

comment

The identified peptide lengths distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000401

synonym

"MS1-5B" NARROW []

2.171. QC:4000215 Identified peptide lengths - sigma

Table 172. Term [QC:4000215]

id

QC:4000215

name

Identified peptide lengths - sigma

def

"From the distribution of identified peptide lengths the sigma value" [PSI:QC]

comment

The identified peptide lengths distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000237

2.172. QC:4000216 Identified peptide lengths - low outliers (<Q1-1.5*IQR)

Table 173. Term [QC:4000216]

id

QC:4000216

name

Identified peptide lengths - low outliers (<Q1-1.5*IQR)

def

"From the distribution of identified peptide lengths, the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The identified peptide lengths distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.173. QC:4000217 Identified peptide lengths - high outliers (>Q3+1.5*IQR)

Table 174. Term [QC:4000217]

id

QC:4000217

name

Identified peptide lengths - high outliers (>Q3+1.5*IQR)

def

"From the distribution of identified peptide lengths, the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The identified peptide lengths distribution can aid the interpretation of digestion efficacy.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.174. QC:4000218 Signal-to-noise ratio in MS1 - Q1, Q2, Q3

Table 175. Term [QC:4000218]

id

QC:4000218

name

Signal-to-noise ratio in MS1 - Q1, Q2, Q3

def

"From the distribution of signal-to-noise ratio in MS1, the quartiles Q1, Q2, Q3 value" [PSI:QC]

comment

The Signal-to-noise ratio in MS1 distribution can provide insight to the presence of nuisance factors.

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.175. QC:4000219 Signal-to-noise ratio in MS1 - mean

Table 176. Term [QC:4000219]

id

QC:4000219

name

Signal-to-noise ratio in MS1 - mean

comment

The signal-to-noise ratio in MS1 distribution can provide insight into the presence of nuisance factors. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

def

"From the distribution of signal-to-noise ratio in MS1, the mean" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.176. QC:4000220 Signal-to-noise ratio in MS1 - sigma

Table 177. Term [QC:4000220]

id

QC:4000220

name

Signal-to-noise ratio in MS1 - sigma

def

"From the distribution of signal-to-noise ratio in MS1, the sigma value" [PSI:QC]

comment

The Signal-to-noise ratio in MS1 distribution can provide insight into the presence of nuisance factors. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.177. QC:4000221 Signal-to-noise ratio in MS1 - low outliers (<Q1-1.5*IQR)

Table 178. Term [QC:4000221]

id

QC:4000221

name

Signal-to-noise ratio in MS1 - low outliers (<Q1-1.5*IQR)

def

"From the distribution of signal-to-noise ratio in MS1, the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

The Signal-to-noise ratio in MS1 distribution can provide insight into the presence of nuisance factors. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.178. QC:4000222 Signal-to-noise ratio in MS1 - high outliers (>Q3+1.5*IQR)

Table 179. Term [QC:4000222]

id

QC:4000222

name

Signal-to-noise ratio in MS1 - high outliers (>Q3+1.5*IQR)

def

"From the distribution of signal-to-noise ratio in MS1, the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

The Signal-to-noise ratio in MS1 distribution can provide insight into the presence of nuisance factors. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.179. QC:4000223 Signal-to-noise ratio in MS2 - Q1, Q2, Q3

Table 180. Term [QC:4000223]

id

QC:4000223

name

Signal-to-noise ratio in MS2 - Q1, Q2, Q3

def

"From the distribution of signal-to-noise ratio in MS2, the quartiles Q1, Q2, Q3 value" [PSI:QC]

comment

A high signal-to-noise ratio in MS2 distribution can explain a high rate of unidentified spectra. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.180. QC:4000224 Signal-to-noise ratio in MS2 - mean

Table 181. Term [QC:4000224]

id

QC:4000224

name

Signal-to-noise ratio in MS2 - mean

def

"From the distribution of signal-to-noise ratio in MS2, the mean" [PSI:QC]

comment

A high signal-to-noise ratio in MS2 distribution can explain a high rate of unidentified spectra. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.181. QC:4000225 Signal-to-noise ratio in MS2 - sigma

Table 182. Term [QC:4000225]

id

QC:4000225

name

Signal-to-noise ratio in MS2 - sigma

def

"From the distribution of signal-to-noise ratio in MS2, the sigma value" [PSI:QC]

comment

A high signal-to-noise ratio in MS2 distribution can explain a high rate of unidentified spectra. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.182. QC:4000226 Signal-to-noise ratio in MS2 - low outliers (<Q1-1.5*IQR)

Table 183. Term [QC:4000226]

id

QC:4000226

name

Signal-to-noise ratio in MS2 - low outliers (<Q1-1.5*IQR)

def

"From the distribution of signal-to-noise ratio in MS2, the list of outliers below Q1-1.5IQR" [PSI:QC]

comment

A high signal-to-noise ratio in MS2 distribution can explain a high rate of unidentified spectra. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.183. QC:4000227 Signal-to-noise ratio in MS2 - high outliers (>Q3+1.5*IQR)

Table 184. Term [QC:4000227]

id

QC:4000227

name

Signal-to-noise ratio in MS2 - high outliers (>Q3+1.5*IQR)

def

"From the distribution of signal-to-noise ratio in MS2, the list of outliers above Q3+1.5IQR" [PSI:QC]

comment

A high signal-to-noise ratio in MS2 distribution can explain a high rate of unidentified spectra. Comparisons will likely only make local sense where the same method of S/N calculation is applied (or overall the same software to calculate this metric, see mzQC 'analysisSoftware').

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.184. QC:4000228 Identified precursor intensity distribution Q1, Q2, Q3

Table 185. Term [QC:4000228]

id

QC:4000228

name

Identified precursor intensity distribution Q1, Q2, Q3

def

"From the distribution of identified precursor intensities, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The intensity distribution of the identified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.185. QC:4000229 Identified precursor intensity distribution - mean

Table 186. Term [QC:4000229]

id

QC:4000229

name

Identified precursor intensity distribution - mean

def

"From the distribution of identified precursor intensities, the mean" [PSI:QC]

comment

The intensity distribution of the identified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000401

2.186. QC:4000230 Identified precursor intensity distribution - sigma

Table 187. Term [QC:4000230]

id

QC:4000230

name

Identified precursor intensity distribution - sigma

def

"From the distribution of identified precursor intensities, the sigma value" [PSI:QC]

comment

The intensity distribution of the identified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units STATO:0000237

2.187. QC:4000231 Identified precursor intensity distribution - low outliers (<Q1-1.5*IQR)

Table 188. Term [QC:4000231]

id

QC:4000231

name

Identified precursor intensity distribution - low outliers (<Q1-1.5*IQR)

def

"From the distribution of identified precursor intensities, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

The intensity distribution of the identified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.188. QC:4000232 Identified precursor intensity distribution - high outliers (>Q3+1.5*IQR)

Table 189. Term [QC:4000232]

id

QC:4000232

name

Identified precursor intensity distribution - high outliers (>Q3+1.5*IQR)

def

"From the distribution of identified precursor intensities, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

The intensity distribution of the identified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.189. QC:4000233 Unidentified precursor intensity distribution - Q1, Q2, Q3

Table 190. Term [QC:4000233]

id

QC:4000233

name

Unidentified precursor intensity distribution - Q1, Q2, Q3

def

"From the distribution of unidentified precursor intensities, the quartiles Q1, Q2, Q3" [PSI:QC]

comment

The intensity distribution of the unidentified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_units STATO:0000167

property_value

has_units STATO:0000574

property_value

has_units STATO:0000170

2.190. QC:4000234 Unidentified precursor intensity distribution - mean

Table 191. Term [QC:4000234]

id

QC:4000234

name

Unidentified precursor intensity distribution - mean

def

"From the distribution of unidentified precursor intensities, the mean" [PSI:QC]

comment

The intensity distribution of the unidentified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000003 single value ! single value

property_value

has_units STATO:0000401

2.191. QC:4000235 Unidentified precursor intensity distribution - sigma

Table 192. Term [QC:4000235]

id

QC:4000235

name

Unidentified precursor intensity distribution - sigma

def

"From the distribution of unidentified precursor intensities, the sigma value" [PSI:QC]

comment

The intensity distribution of the unidentified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000003 single value ! single value

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

property_value

has_units STATO:0000237

2.192. QC:4000236 Unidentified precursor intensity distribution - low outliers (<Q1-1.5*IQR)

Table 193. Term [QC:4000236]

id

QC:4000236

name

Unidentified precursor intensity distribution - low outliers (<Q1-1.5*IQR)

def

"From the distribution of unidentified precursor intensities, the list of outliers below Q1-1.5*IQR" [PSI:QC]

comment

The intensity distribution of the unidentified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000117

2.193. QC:4000237 Unidentified precursor intensity distribution - high outliers (>Q3+1.5*IQR)

Table 194. Term [QC:4000237]

id

QC:4000237

name

Unidentified precursor intensity distribution - high outliers (>Q3+1.5*IQR)

def

"From the distribution of unidentified precursor intensities, the list of outliers above Q3+1.5*IQR" [PSI:QC]

comment

The intensity distribution of the unidentified precursors informs about the dynamic range of the acquisition in relation to identifiability.

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000004 n-tuple ! n-tuple

property_value

has_column QC:4000118

2.194. QC:4000238 Charge state

Table 195. Term [QC:4000238]

id

QC:4000238

name

Charge state

def

"The column contains charge states." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units MS:1000041

2.195. QC:4000239 Fraction

Table 196. Term [QC:4000239]

id

QC:4000239

name

Fraction

def

"The column contains fraction values as decimals." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000191

2.196. QC:4000240 Humidity

Table 197. Term [QC:4000240]

id

QC:4000240

name

Humidity

def

"The column contains relative humidity values in percent." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000187

2.197. QC:4000241 Observed MS1 feature areas

Table 198. Term [QC:4000241]

id

QC:4000241

name

Observed MS1 feature areas

def

"Observed MS1 feature areas." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type MS:1001844

2.198. QC:4000242 QC2 sample MS1 feature areas

Table 199. Term [QC:4000242]

id

QC:4000242

name

QC2 sample MS1 feature areas

def

"Observed MS1 feature area from selected peptides of a QC2 sample measurement within 5 ppm and +/- 240 s RT tolerance. Selected peptides in the first column to be expected: 'YAEAVTR','STLTDSLVC(Carbamidomethyl)K','SLADELALVDVLEDK','NPDDITNEEYGEFYK','LAVDEEENADNNTK','FEELNMDLFR','EAALSTALSEK','DDVAQTDLLQIDPNFGSK','RFPGYDSESK','EATTEFSVDAR','EQFLDGDGWTSR','TPAQFDADELR','LGDLYEEEMR','EVSTYIK','FAFQAEVNR'" [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column: QC:4000116 ! Peptide sequence

property_value

has_column: QC:4000241 ! Observed MS1 feature areas

2.199. QC:4000243 Observed mass accuracies

Table 200. Term [QC:4000243]

id

QC:4000243

name

Observed mass accuracies

def

"Observed mass accuracy calculated by 1E6 x (observed mz - theoretical mz)/theoretical mz of selected peptides." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type MS:1000014

property_value

has_units UO:0000169

2.200. QC:4000244 QC2 sample mass accuracies

Table 201. Term [QC:4000244]

id

QC:4000244

name

QC2 sample mass accuracies

def

"Observed mass accuracy from selected peptides of a QC2 sample measurement. Selected peptides in the first column to be expected: 'YAEAVTR','STLTDSLVC(Carbamidomethyl)K','SLADELALVDVLEDK','NPDDITNEEYGEFYK','LAVDEEENADNNTK','FEELNMDLFR','EAALSTALSEK','DDVAQTDLLQIDPNFGSK','RFPGYDSESK','EATTEFSVDAR','EQFLDGDGWTSR','TPAQFDADELR','LGDLYEEEMR','EVSTYIK','FAFQAEVNR'" [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000006 table ! table

property_value

has_column: QC:4000116 ! Peptide sequence

property_value

has_column: QC:4000243 ! Observed mass accuracies

2.201. QC:4000245 Number of different undistinguishable proteins groups from all PSM

Table 202. Term [QC:4000245]

id

QC:4000245

name

Number of different undistinguishable proteins groups from all PSM

def

"Number of different undistinguishable proteins groups from all PSM after FDR filtering. (Only undistinguishability groups.)" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000009 ID based ! ID based

is_a

QC:4000001 QC metric ! QC metric

property_value

has_units UO:0000189

2.202. QC:4000246 Run name

Table 203. Term [QC:4000246]

id

QC:4000246

name

Run name

def

"The column contains run names as defined by runQuality inputFile name." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

2.203. QC:4000247 PCA Dimension 1

Table 204. Term [QC:4000247]

id

QC:4000247

name

PCA Dimension 1

def

"The column contains Principal Component Analysis scores from the first eigenvalue dimension." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type STATO:0000587

2.204. QC:4000248 PCA Dimension 2

Table 205. Term [QC:4000248]

id

QC:4000248

name

PCA Dimension 2

def

"The column contains Principal Component Analysis scores from the second eigenvalue dimension." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type STATO:0000587

2.205. QC:4000249 PCA Dimension 3

Table 206. Term [QC:4000249]

id

QC:4000249

name

PCA Dimension 3

def

"The column contains Principal Component Analysis scores from the third eigenvalue dimension." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type STATO:0000587

2.206. QC:4000250 PCA Dimension 4

Table 207. Term [QC:4000250]

id

QC:4000250

name

PCA Dimension 4

def

"The column contains Principal Component Analysis scores from the fourth eigenvalue dimension." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type STATO:0000587

2.207. QC:4000251 PCA Dimension 5

Table 208. Term [QC:4000251]

id

QC:4000251

name

PCA Dimension 5

def

"The column contains Principal Component Analysis scores from the fifth eigenvalue dimension." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_type STATO:0000587

2.208. QC:4000252 Batch label

Table 209. Term [QC:4000252]

id

QC:4000252

name

Batch label

def

"The column contains batch label names" [PSI:QC]

is_a

QC:4000107 Column type ! Column type

2.209. QC:4000253 Injection sequence number

Table 210. Term [QC:4000253]

id

QC:4000253

name

Injection sequence number

def

"The column contains the order in which the runs were acquired. Numbers may be missing due to unrelated samples being run." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

2.210. QC:4000254 Peak area feature PCA result

Table 211. Term [QC:4000254]

id

QC:4000254

name

Peak area feature PCA result

def

"PCA score result from multiple runs with (log transformed) peak area input features before batch correction." [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000006 table ! table

property_value

has_column: QC:4000246 ! Run name

property_value

has_column: QC:4000247 ! PCA Dimension 1

property_value

has_column: QC:4000248 ! PCA Dimension 2

property_value

has_optional_column: QC:4000249 ! PCA Dimension 3

property_value

has_optional_column: QC:4000250 ! PCA Dimension 4

property_value

has_optional_column: QC:4000251 ! PCA Dimension 5

property_value

has_optional_column: QC:4000252 ! Batch label

property_value

has_optional_column: QC:4000253 ! Injection sequence number

2.211. QC:4000255 Batch corrected peak area feature PCA result

Table 212. Term [QC:4000255]

id

QC:4000255

name

Batch corrected peak area feature PCA result

def

"PCA score result from multiple runs with (log transformed) peak area input features after batch correction." [PSI:QC]

is_a

QC:4000001 QC metric ! QC metric

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000006 table ! table

property_value

has_column: QC:4000246 ! Run name

property_value

has_column: QC:4000247 ! PCA Dimension 1

property_value

has_column: QC:4000248 ! PCA Dimension 2

property_value

has_optional_column: QC:4000249 ! PCA Dimension 3

property_value

has_optional_column: QC:4000250 ! PCA Dimension 4

property_value

has_optional_column: QC:4000251 ! PCA Dimension 5

property_value

has_optional_column: QC:4000252 ! Batch label

property_value

has_optional_column: QC:4000253 ! Injection sequence number

2.212. QC:4000256 Metabolomics metric

Table 213. Term [QC:4000256]

id

QC:4000256

name

Metabolomics metric

def

"Metrics for metabolomics experiments." [PSI:QC]

is_a

QC:4000008 QC metric basis ! QC metric basis

2.213. QC:4000257 "Detected Compounds"

Table 214. Term [QC:4000257]

id

QC:4000257

name

"Detected Compounds"

def

"Number of detected compounds from a given library of target compounds in a specific run." [PSI:QC]

is_a

QC:4000256 Metabolomics metric ! Metabolomics metric

is_a

QC:4000003 single value ! single value

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

property_value

has_units UO:0000189

2.214. QC:4000258 Maximal MS1 frequency

Table 215. Term [QC:4000258]

id

QC:4000258

name

Maximal MS1 frequency

def

"The fastest frequency for MS collection in any minute over the complete run" [PSI:QC]

is_a

QC:4000003 single value ! single value

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000023 MS1 metric ! MS1 metric

relationship

has_relation [MS:1000029] ! sampling frequency

relationship

has_relation [MS:1000580] ! MSn spectrum

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

property_value

has_units UO:0000106

synonym

"MS1-Freq-Max" EXACT []

2.215. QC:4000259 MS1 density per quantile

Table 216. Term [QC:4000259]

id

QC:4000259

name

MS1 density per quantile

def

"The first to n-th quantile of MS2 scan peak counts." [PSI:QC]

is_a

QC:4000004 n-tuple ! n-tuple

is_a

QC:4000010 ID free ! ID free

is_a

QC:4000023 MS1 metric ! MS2 metric

relationship

has_relation [MS:1000035] ! peak picking

relationship

has_relation QC:4000013 QC metric relation: single run ! QC metric relation: one run

synonym

MS1-Density-Q1" RELATED []

synonym

MS1-Density-Q2" RELATED []

synonym

MS1-Density-Q3" RELATED []

2.216. QC:4000260 Percent

Table 217. Term [QC:4000260]

id

QC:4000260

name

Percent

def

"The column contains percentages of one type." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000187

2.217. QC:4000261 Pressure

Table 218. Term [QC:4000261]

id

QC:4000261

name

Pressure

def

"The column contains measurments of pressure in pascal." [PSI:QC]

is_a

QC:4000107 Column type ! Column type

property_value

has_units UO:0000110