Ligand‐Supported Homology Modeling of G‐Protein‐Coupled Receptor Sites: Models Sufficient for Successful Virtual Screening | Zendy

Evers Andreas | Zendy; Klebe Gerhard | Zendy

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Ligand‐Supported Homology Modeling of G‐Protein‐Coupled Receptor Sites: Models Sufficient for Successful Virtual Screening

Author(s) -

Evers Andreas,

Klebe Gerhard

Publication year - 2003

Publication title -

angewandte chemie international edition

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 5.831

H-Index - 550

eISSN - 1521-3773

pISSN - 1433-7851

DOI - 10.1002/anie.200352776

Subject(s) - virtual screening , homology modeling , computational biology , construct (python library) , computer science , homology (biology) , ligand (biochemistry) , g protein coupled receptor , receptor , bioinformatics , drug discovery , biology , genetics , biochemistry , programming language , amino acid , enzyme

Virtual proteins : A computer method is described that uses ligand information in the homology modeling of proteins. This method was used to construct a model of a G‐protein‐coupled receptor, which was successfully used as a basis for structure‐based drug design by virtual computer screening (see picture).

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