MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments

<p>Abstract</p> <p>Background</p> <p>Relative isotope abundance quantification, which can be used for peptide identification and differential peptide quantification, plays an important role in liquid chromatography-mass spectrometry (LC-MS)-based proteomics. However, se...

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Main Authors: Haskins William E, Petritis Konstantinos, Zhang Jianqiu
Format: Article
Language:English
Published: BMC 2011-03-01
Series:BMC Bioinformatics
Online Access:http://www.biomedcentral.com/1471-2105/12/74
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author Haskins William E
Petritis Konstantinos
Zhang Jianqiu
author_facet Haskins William E
Petritis Konstantinos
Zhang Jianqiu
author_sort Haskins William E
collection DOAJ
description <p>Abstract</p> <p>Background</p> <p>Relative isotope abundance quantification, which can be used for peptide identification and differential peptide quantification, plays an important role in liquid chromatography-mass spectrometry (LC-MS)-based proteomics. However, several major issues exist in the relative isotopic quantification of peptides on time-of-flight (TOF) instruments: LC peak boundary detection, thermal noise suppression, interference removal and mass drift correction. We propose to use the Maximum Ratio Combining (MRC) method to extract MS signal templates for interference detection/removal and LC peak boundary detection. In our method, MRCQuant, MS templates are extracted directly from experimental values, and the mass drift in each LC-MS run is automatically captured and compensated. We compared the quantification accuracy of MRCQuant to that of another representative LC-MS quantification algorithm (msInspect) using datasets downloaded from a public data repository.</p> <p>Results</p> <p>MRCQuant showed significant improvement in the number of accurately quantified peptides.</p> <p>Conclusions</p> <p>MRCQuant effectively addresses major issues in the relative quantification of LC-MS-based proteomics data, and it provides improved performance in the quantification of low abundance peptides.</p>
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spelling doaj.art-998e80a31d3642bd9cb0ab404bdb25682022-12-22T03:11:25ZengBMCBMC Bioinformatics1471-21052011-03-011217410.1186/1471-2105-12-74MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instrumentsHaskins William EPetritis KonstantinosZhang Jianqiu<p>Abstract</p> <p>Background</p> <p>Relative isotope abundance quantification, which can be used for peptide identification and differential peptide quantification, plays an important role in liquid chromatography-mass spectrometry (LC-MS)-based proteomics. However, several major issues exist in the relative isotopic quantification of peptides on time-of-flight (TOF) instruments: LC peak boundary detection, thermal noise suppression, interference removal and mass drift correction. We propose to use the Maximum Ratio Combining (MRC) method to extract MS signal templates for interference detection/removal and LC peak boundary detection. In our method, MRCQuant, MS templates are extracted directly from experimental values, and the mass drift in each LC-MS run is automatically captured and compensated. We compared the quantification accuracy of MRCQuant to that of another representative LC-MS quantification algorithm (msInspect) using datasets downloaded from a public data repository.</p> <p>Results</p> <p>MRCQuant showed significant improvement in the number of accurately quantified peptides.</p> <p>Conclusions</p> <p>MRCQuant effectively addresses major issues in the relative quantification of LC-MS-based proteomics data, and it provides improved performance in the quantification of low abundance peptides.</p>http://www.biomedcentral.com/1471-2105/12/74
spellingShingle Haskins William E
Petritis Konstantinos
Zhang Jianqiu
MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
BMC Bioinformatics
title MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
title_full MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
title_fullStr MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
title_full_unstemmed MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
title_short MRCQuant- an accurate LC-MS relative isotopic quantification algorithm on TOF instruments
title_sort mrcquant an accurate lc ms relative isotopic quantification algorithm on tof instruments
url http://www.biomedcentral.com/1471-2105/12/74
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AT zhangjianqiu mrcquantanaccuratelcmsrelativeisotopicquantificationalgorithmontofinstruments