A combined approach of docking and 3D QSAR study of β-ketoacyl-acyl carrier protein synthase III (FabH) inhibitors

Bioorganic and Medicinal Chemistry

Volumn 14, Issue 5, 2006, Pages 1474-1482

  Ashek, Ali ^a,b   Cho, Seung Joo ^a  

^a Korea Institute of Science and Technology   (South Korea)

^b University of Science and Technology (UST)   (South Korea)

Author keywords

Antibiotic; CoMFA; CoMSIA; Docking; FabH

Indexed keywords

3 OXOACYL ACYL CARRIER PROTEIN SYNTHASE; ANTIINFECTIVE AGENT; ANTIPARASITIC AGENT; BENZOIC ACID DERIVATIVE; BENZOYLAMINOBENZOIC ACID; FATTY ACID SYNTHASE; UNCLASSIFIED DRUG;

ARTICLE; CATALYSIS; COMPARATIVE MOLECULAR FIELD ANALYSIS; COMPARATIVE MOLECULAR SIMILARITY INDICES ANALYSIS; DRUG ACTIVITY; FATTY ACID SYNTHESIS; MATHEMATICAL ANALYSIS; NONHUMAN; PROTEIN PROTEIN INTERACTION; QUANTITATIVE STRUCTURE ACTIVITY RELATION; THREE DIMENSIONAL IMAGING;

3-OXOACYL-(ACYL-CARRIER-PROTEIN) SYNTHASE; AMINO ACIDS; ANTI-BACTERIAL AGENTS; ANTIPARASITIC AGENTS; BINDING SITES; CATALYSIS; COMPUTER SIMULATION; DATABASES, FACTUAL; ENZYME INHIBITORS; FATTY ACIDS; LIGANDS; MODELS, MOLECULAR; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 31044451279     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2005.10.001     Document Type: Article

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