Novel inhibitors of Mycobacterium tuberculosis dTDP-6-deoxy-L-lyxo-4-hexulose reductase (RmlD) identified by virtual screening.

Wang, Yi; Hess, Tamara Noelle; Jones, Victoria; Zhou, Joe Zhongxiang; McNeil, Michael R; Andrew McCammon, J

Wang, Yi; Hess, Tamara Noelle; Jones, Victoria; Zhou, Joe Zhongxiang; McNeil, Michael R; Andrew McCammon, J.

Affiliation

Wang Y; Center for Theoretical Biological Physics, Howard Hughes Medical Institute, Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, CA 92093, USA.

Bioorg Med Chem Lett ; 21(23): 7064-7, 2011 Dec 01.

Article in En | MEDLINE | ID: mdl-22014548

Subject(s)

Antitubercular Agents; Computer-Aided Design; Drug Discovery; Enzyme Inhibitors; Mycobacterium tuberculosis; Sugar Alcohol Dehydrogenases/antagonists & inhibitors; Antitubercular Agents/chemistry; Antitubercular Agents/pharmacology; Binding Sites; Crystallography, X-Ray; Enzyme Activation/drug effects; Enzyme Inhibitors/chemistry; Enzyme Inhibitors/pharmacology; Inhibitory Concentration 50; Models, Molecular; Mycobacterium tuberculosis/drug effects; Mycobacterium tuberculosis/enzymology

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Sugar Alcohol Dehydrogenases / Computer-Aided Design / Enzyme Inhibitors / Drug Discovery / Mycobacterium tuberculosis / Antitubercular Agents Type of study: Diagnostic_studies / Screening_studies Language: En Journal: Bioorg Med Chem Lett Journal subject: BIOQUIMICA / QUIMICA Year: 2011 Type: Article Affiliation country: United States

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