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Bioinformatics Advance Access originally published online on December 21, 2004
Bioinformatics 2005 21(8):1451-1456; doi:10.1093/bioinformatics/bti233
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© The Author 2004. Published by Oxford University Press. All rights reserved. For Permissions, please email: journals.permissions{at}oupjournals.org

A structure-based method for protein sequence alignment

Maricel G. Kann , Paul A. Thiessen , Anna R. Panchenko , Alejandro A. Schäffer , Stephen F. Altschul and Stephen H. Bryant *

National Center for Biotechnology Information, National Library of Medicine, National Institutes of Health, Department of Health and Human Services Bethesda, MD 20894, USA

*To whom correspondence should be addressed.

Motivation: With the continuing rapid growth of protein sequence data, protein sequence comparison methods have become the most widely used tools of bioinformatics. Among these methods are those that use position-specific scoring matrices (PSSMs) to describe protein families. PSSMs can capture information about conserved patterns within families, which can be used to increase the sensitivity of searches for related sequences. Certain types of structural information, however, are not generally captured by PSSM search methods. Here we introduce a program, Structure-based ALignment TOol (SALTO), that aligns protein query sequences to PSSMs using rules for placing and scoring gaps that are consistent with the conserved regions of domain alignments from NCBI's Conserved Domain Database.

Results: In most cases, the alignment scores obtained using the local alignment version follow an extreme value distribution. SALTO's performance in finding related sequences and producing accurate alignments is similar to or better than that of IMPALA; one advantage of SALTO is that it imposes an explicit gapping model on each protein family.

Availability: A stand-alone version of the program that can generate global or local alignments is available by ftp distribution (ftp://ftp.ncbi.nih.gov/pub/SALTO/), and has been incorporated to Cn3D structure/alignment viewer.

Contact: bryant{at}ncbi.nlm.nih.gov


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