Ligand-supported homology modeling of G-protein-coupled receptor sites: Models sufficient for successful virtual screening

被引：82

作者：

Evers, A ^{[1
]}

Klebe, G ^{[1
]}

机构：

[1] Univ Marburg, Inst Pharmazeut Chem, D-35032 Marburg, Germany

来源：

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION | 2004年 / 43卷 / 02期

关键词：

computer chemistry; G proteins; protein models; receptors;

D O I：

10.1002/anie.200352776

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

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).

引用

页码：248 / 251

页数：4

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