Structure-based function prediction: approaches and applications

Brief Funct Genomic Proteomic. 2008 Jul;7(4):291-302. doi: 10.1093/bfgp/eln030. Epub 2008 Jul 3.

Abstract

The ever increasing number of protein structures determined by structural genomic projects has spurred much interest in the development of methods for structure-based function prediction. Existing methods can be roughly classified in two groups: some use a comparative approach looking for the presence of structural motifs possibly associated with a known biochemical function. Other methods try to identify functional patches on the surface of a protein using only its physicochemical characteristics. This review will cover both kinds of approaches to structure-based function prediction as well as their use in real-world cases. The main issues and limitations in using protein structure to predict function will also be discussed. These are mainly: the assessment of the statistical significance of structural similarities and the extent to which these methods depend on the accuracy and availability of structural data.

Publication types

  • Research Support, Non-U.S. Gov't
  • Review

MeSH terms

  • Amino Acid Motifs
  • Databases, Protein
  • Models, Molecular
  • Predictive Value of Tests
  • Protein Conformation
  • Proteins / chemistry*
  • Proteins / metabolism*
  • Sequence Alignment / methods
  • Sequence Analysis, Protein / methods
  • Structure-Activity Relationship

Substances

  • Proteins