Protein structure comparison by probability-based matching of secondary structure elements

Bioinformatics. 2003 Apr 12;19(6):735-41. doi: 10.1093/bioinformatics/btg058.

Abstract

Motivation: Protein structure comparison (PSC) has been used widely in studies of structural and functional genomics. However, PSC is computationally expensive and as a result almost all of the PSC methods currently in use look only for the optimal alignment and ignore many alternative alignments that are statistically significant and that may provide insight into protein evolution or folding.

Results: We have developed a new PSC method with efficiency to detect potentially viable alternative alignments in all-against-all database comparisons. The efficiency of the new PSC method derives from the ability to directly home in on a limited number of viable and ranked alignment solutions based on intuitively derived SSE (secondary structure element)-matching probabilities.

Publication types

  • Comparative Study
  • Evaluation Study
  • Research Support, Non-U.S. Gov't
  • Validation Study

MeSH terms

  • Algorithms*
  • Amino Acid Sequence
  • Models, Molecular*
  • Models, Statistical*
  • Molecular Sequence Data
  • Protein Conformation
  • Protein Structure, Secondary
  • Proteins / chemistry*
  • Proteins / classification*
  • Quality Control
  • Sequence Alignment / methods*
  • Sequence Analysis, Protein / methods*

Substances

  • Proteins