AlphaCRV: a pipeline for identifying accurate binder topologies in mass-modeling with AlphaFold

Francisco J. Guzmán-Vega, Stefan T. Arold*

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

Abstract

Motivation: The speed and accuracy of deep learning-based structure prediction algorithms make it now possible to perform in silico "pull-downs"to identify protein-protein interactions on a proteome-wide scale. However, on such a large scale, existing scoring algorithms are often insufficient to discriminate biologically relevant interactions from false positives. Results: Here, we introduce AlphaCRV, a Python package that helps identify correct interactors in a one-against-many AlphaFold screen by clustering, ranking, and visualizing conserved binding topologies, based on protein sequence and fold.

Original languageEnglish (US)
Article numbervbae131
JournalBioinformatics Advances
Volume4
Issue number1
DOIs
StatePublished - 2024

Bibliographical note

Publisher Copyright:
© 2024 The Author(s).

ASJC Scopus subject areas

  • Structural Biology
  • Molecular Biology
  • Genetics
  • Computer Science Applications

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