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Intrinsic protein disorder and conditional folding in AlphaFoldDB.

Damiano PiovesanAlexander Miguel MonzonSilvio C E Tosatto
Published in: Protein science : a publication of the Protein Society (2022)
Intrinsically disordered regions (IDRs) defying the traditional protein structure-function paradigm have been difficult to analyze. The availability of accurate structure predictions on a large scale in AlphaFoldDB offers a fresh perspective on IDR prediction. Here, we establish three baselines for IDR prediction from AlphaFoldDB models based on the recent CAID dataset. Surprisingly, AlphaFoldDB is highly competitive for predicting both IDRs and conditionally folded binding regions, demonstrating the plasticity of the disorder to structure continuum.
Keyphrases
  • binding protein
  • amino acid
  • molecular dynamics simulations
  • small molecule
  • transcription factor