Docking studies on kinesin spindle protein inhibitors: An important cooperative 'minor binding pocket' which increases the binding affinity significantly

Journal of Molecular Modeling

Volumn 13, Issue 9, 2007, Pages 987-992

  Jiang, Cheng ^a   Chen, Yadong ^a   Wang, Xiaojian ^a   You, Qidong ^a  

^a CHINA PHARMACEUTICAL UNIVERSITY   (China)

Author keywords

Binding pocket; Docking; KSP inhibitors

Indexed keywords

BENZAMIDE DERIVATIVE; CYSTEINE DERIVATIVE; KINESIN; KINESIN SPINDLE PROTEIN; MONASTROL; PROTEIN INHIBITOR; UNCLASSIFIED DRUG;

ARTICLE; BINDING AFFINITY; BINDING SITE; CHEMICAL STRUCTURE; COMPUTER PROGRAM; CONCENTRATION RESPONSE; CONTROLLED STUDY; CRYSTAL STRUCTURE; DIELECTRIC CONSTANT; ENERGY; HYDROGEN BOND; HYDROPHOBICITY; LIGAND BINDING; LINEAR SYSTEM; PRIORITY JOURNAL; RECEPTOR BINDING; STRUCTURE ACTIVITY RELATION;

AMINO ACID SEQUENCE; AMINO ACIDS; CYSTEINE; DITERPENES; HYDROGEN BONDING; INDOLES; KINESIN; MITOTIC SPINDLE APPARATUS; MODELS, MOLECULAR; PHENOLS; PROTEIN BINDING; PYRIMIDINES; THIONES;

EID: 34547614098     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-007-0219-2     Document Type: Article

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