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sc-PDB: a database for identifying variations and multiplicity of ‘druggable’ binding sites in proteins
Author(s) -
Jamel Meslamani,
Didier Rognan,
Esther Kellenberger
Publication year - 2011
Publication title -
bioinformatics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 3.599
H-Index - 390
eISSN - 1367-4811
pISSN - 1367-4803
DOI - 10.1093/bioinformatics/btr120
Subject(s) - protein data bank (rcsb pdb) , druggability , protein data bank , active site , docking (animal) , computational biology , binding site , allosteric regulation , database , protein structure , computer science , chemistry , biology , stereochemistry , biochemistry , enzyme , medicine , nursing , gene
The sc-PDB database is an annotated archive of druggable binding sites extracted from the Protein Data Bank. It contains all-atoms coordinates for 8166 protein-ligand complexes, chosen for their geometrical and physico-chemical properties. The sc-PDB provides a functional annotation for proteins, a chemical description for ligands and the detailed intermolecular interactions for complexes. The sc-PDB now includes a hierarchical classification of all the binding sites within a functional class.

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