X-ray and molecular modelling in fragment-based design of three small quinoline scaffolds for HIV integrase inhibitors

Bioorganic and Medicinal Chemistry

Volumn 19, Issue 5, 2011, Pages 1606-1612

  Majerz Maniecka, Katarzyna ^a   Musiol, Robert ^b   Skórska Stania, Agnieszka ^a   Tabak, Dominik ^b   Mazur, Pawel ^b   Oleksyn, Barbara J ^a   Polanski, Jaroslaw ^b  

^a JAGIELLONIAN UNIVERSITY   (Poland)

^b UNIVERSITY OF SILESIA   (Poland)

Author keywords

Crystal structure; Fragment based drug design; HIV integrase; Quinolines

Indexed keywords

CARBOXYLIC ACID DERIVATIVE; COBALT CHLORIDE; INTEGRASE; INTEGRASE INHIBITOR; LIGAND; QUINALDINE DERIVATIVE; QUINOLINE DERIVATIVE;

ARTICLE; CRYSTAL STRUCTURE; CRYSTALLIZATION; DRUG DESIGN; DRUG POTENCY; ENZYME ACTIVE SITE; HYDROGEN BOND; MOLECULAR DOCKING; MOLECULAR INTERACTION; MOLECULAR MODEL; X RAY CRYSTALLOGRAPHY;

CATALYTIC DOMAIN; CRYSTALLOGRAPHY, X-RAY; DRUG DESIGN; HIV INTEGRASE; HIV INTEGRASE INHIBITORS; HIV-1; INHIBITORY CONCENTRATION 50; LIGANDS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; QUINOLINES;

EID: 79952194265     PISSN: 09680896     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.bmc.2011.01.045     Document Type: Article

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