Structure-based validation can drastically underestimate error rate in proteome-wide cross-linking mass spectrometry studies

Nat Methods. 2020 Oct;17(10):985-988. doi: 10.1038/s41592-020-0959-9. Epub 2020 Sep 29.

Abstract

Thorough quality assessment of novel interactions identified by proteome-wide cross-linking mass spectrometry (XL-MS) studies is critical. Almost all current XL-MS studies have validated cross-links against known three-dimensional structures of representative protein complexes. Here, we provide theoretical and experimental evidence demonstrating that this approach can drastically underestimate error rates for proteome-wide XL-MS datasets, and propose a comprehensive set of four data-quality metrics to address this issue.

Publication types

  • Research Support, N.I.H., Extramural
  • Research Support, U.S. Gov't, Non-P.H.S.

MeSH terms

  • Cross-Linking Reagents / chemistry
  • Databases, Protein
  • Humans
  • Mass Spectrometry / methods*
  • Protein Conformation
  • Proteome*
  • Proteomics / methods*
  • Reproducibility of Results

Substances

  • Cross-Linking Reagents
  • Proteome