Improvement of protein quantification for proteins with shared peptides by using bipartite peptide-protein graphs

dc.contributor.advisorRahnenführer, Jörg
dc.contributor.authorSchork, Karin Ulrike
dc.contributor.refereeEisenacher, Martin
dc.date.accepted2024-12-04
dc.date.accessioned2025-03-10T10:48:58Z
dc.date.available2025-03-10T10:48:58Z
dc.date.issued2024
dc.description.abstractIn bottom-up proteomics, proteins are enzymatically digested to peptides, smaller amino acid chains, which are then measured via mass spectrometry. The received peptide quantities need to be summarized to protein quantities to obtain biological insights (protein quantification). This is complicated by the presence of shared peptides that occur in multiple protein sequences. The relationship between peptides and corresponding proteins can be represented as bipartite graphs. A novel protein quantification method, called bppgQuant, is proposed which calculates protein ratios from peptide ratios. It uses the structures of the bipartite peptide-protein graphs to build an equation system. As this system is not exactly solvable in many cases, an optimization problem is formulated to find solutions which minimize the sum of squared error terms. bppgQuant is evaluated and compared to the methods SCAMPI and PQP using four different quantitative datasets from different organisms, that contain known protein ratios. In summary, bppgQuant showed good results in comparison to SCAMPI and PQP, especially when protein nodes not needed to explain the measured peptide ratios were removed before optimization.en
dc.identifier.urihttp://hdl.handle.net/2003/43528
dc.identifier.urihttp://dx.doi.org/10.17877/DE290R-25361
dc.language.isoen
dc.subjectProteomicsen
dc.subjectBipartite graphsen
dc.subjectProtein quantificationen
dc.subjectOptimizationen
dc.subjectBioinformaticsen
dc.subject.ddc310
dc.subject.rswkProteomanalysede
dc.subject.rswkPeptidede
dc.subject.rswkBipartiter Graphde
dc.subject.rswkParameterschätzungde
dc.subject.rswkMethode der kleinsten Quadratede
dc.titleImprovement of protein quantification for proteins with shared peptides by using bipartite peptide-protein graphsen
dc.typeText
dc.type.publicationtypePhDThesis
dcterms.accessRightsopen access
eldorado.secondarypublicationfalse

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