Bioinformatics Advance Access originally published online on July 16, 2008
Bioinformatics 2008 24(18):2094-2095; doi:10.1093/bioinformatics/btn371
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MetalDetector: a web server for predicting metal-binding sites and disulfide bridges in proteins from sequence
1Machine Learning and Neural Networks Group, Dipartimento di Sistemi e Informatica, Università degli Studi di Firenze, Via di Santa Marta 3, 50139 Firenze, Italy, 2Department of Biochemistry and Molecular Biophysics, Columbia University, 630 West 168th Street, 3Columbia University Center for Computational Biology and Bioinformatics (C2B2), 1130 St Nicholas Ave. and 4Northeast Structural Genomics Consortium (NESG), Columbia University, 1130 St Nicholas Ave. Rm. 802, New York, NY 10032, USA
*To whom correspondence should be addressed.
| Abstract |
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Summary: The web server MetalDetector classifies histidine residues in proteins into one of two states (free or metal bound) and cysteines into one of three states (free, metal bound or disulfide bridged). A decision tree integrates predictions from two previously developed methods (DISULFIND and Metal Ligand Predictor). Cross-validated performance assessment indicates that our server predicts disulfide bonding state at 88.6% precision and 85.1% recall, while it identifies cysteines and histidines in transition metal-binding sites at 79.9% precision and 76.8% recall, and at 60.8% precision and 40.7% recall, respectively.
Availability: Freely available at http://metaldetector.dsi.unifi.it
Contact: metaldetector{at}dsi.unifi.it
Supplementary Information: Details and data can be found at http://metaldetector.dsi.unifi.it/help.php
Associate Editor: John Quackenbush
Received on April 17, 2008; revised on June 27, 2008; accepted on July 14, 2008