Comparative docking studies of labdane-type diterpenes with forskolin at the active site of adenylyl cyclase

Bioorganic and Medicinal Chemistry

Volumn 16, Issue 17, 2008, Pages 8237-8243

  Koukoulitsa, Catherine ^a   Zervou, Maria ^a   Demetzos, Costas ^b   Mavromoustakos, Thomas ^a,b  

^a INSTITUTE OF BIOLOGY   (Greece)

^b UNIVERSITY OF ATHENS   (Greece)

Author keywords

2D NMR; Adenylyl cyclase; Cistus; Docking; Labd 13(E) ene 8a,15 diol; Labdane type diterpenes; Molecular modeling

Indexed keywords

ADENYLATE CYCLASE; DITERPENE; ENZYME ACTIVATOR; FORSKOLIN; LABD 13 ENE 8A,15 DIOL; UNCLASSIFIED DRUG;

ARTICLE; BINDING AFFINITY; CANCER CELL CULTURE; CONFORMATIONAL TRANSITION; CYTOSTASIS; CYTOTOXICITY; DRUG BINDING; DRUG CONFORMATION; DRUG EFFECT; DRUG SYNTHESIS; DRUG TARGETING; ENZYME ACTIVATION; MOLECULAR DYNAMICS; MOLECULAR MODEL; STRUCTURE ACTIVITY RELATION;

ADENYLATE CYCLASE; BINDING SITES; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; DITERPENES; FORSKOLIN; LIGANDS; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; REFERENCE STANDARDS; STEREOISOMERISM; STRUCTURE-ACTIVITY RELATIONSHIP;

CISTUS;

EID: 50349086914     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2008.07.061     Document Type: Article

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