Journal
JOURNAL OF PROTEOME RESEARCH
Volume 8, Issue 8, Pages 4109-4115Publisher
AMER CHEMICAL SOC
DOI: 10.1021/pr900064b
Keywords
proteome analysis; two-dimensional separation; tandem mass spectrometry; retention time prediction; statistical learning; Sorangium cellulosum
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Funding
- Bruker Daltonics, Bremen, Germany
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The combination of a two-dimensional peptide separation scheme based on reversed-phase and ion-pair reversed phase HPLC with a computational method to model and predict retention times in both dimensions is described. The algorithm utilizes statistical learning to establish a retention model from about 200 peptide retention times and their corresponding sequences. The application of retention time prediction to the peptides facilitated an increase in true positive peptide identifications upon lowering mass spectrometric scoring thresholds and concomitantly filtering out false positives on the basis of predicted retention times. An approximately 19% increase in the number of peptide identifications at a q-value of 0.01 was achievable in a whole proteome measurement.
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