4.8 Article

Genomics-aided structure prediction

出版社

NATL ACAD SCIENCES
DOI: 10.1073/pnas.1207864109

关键词

protein folding; residue contact prediction; contact map estimation; residue-residue coevolution; statistical potentials

资金

  1. National Science Foundation through the Center for Theoretical Biological Physics [PHY-0822283, NSF-MCB-1214457]
  2. Direct For Biological Sciences
  3. Div Of Molecular and Cellular Bioscience [1214457] Funding Source: National Science Foundation
  4. Division Of Physics
  5. Direct For Mathematical & Physical Scien [1308264] Funding Source: National Science Foundation

向作者/读者索取更多资源

We introduce a theoretical framework that exploits the ever-increasing genomic sequence information for protein structure prediction. Structure-based models are modified to incorporate constraints by a large number of non-local contacts estimated from direct coupling analysis (DCA) of co-evolving genomic sequences. A simple hybrid method, called DCA-fold, integrating DCA contacts with an accurate knowledge of local information (e. g., the local secondary structure) is sufficient to fold proteins in the range of 1-3 angstrom resolution.

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