1P44

Targeting tuberculosis and malaria through inhibition of enoyl reductase: compound activity and structural data

Summary for 1P44

Entry DOI	10.2210/pdb1p44/pdb
Descriptor	Enoyl-[acyl-carrier-protein] reductase [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE, 5-{[4-(9H-FLUOREN-9-YL)PIPERAZIN-1-YL]CARBONYL}-1H-INDOLE, ... (4 entities in total)
Functional Keywords	inha, short chain dehydrogenase reductase, inhibitor, rossmann fold, enoyl-acp reductase, structural genomics, psi, protein structure initiative, tb structural genomics consortium, tbsgc, oxidoreductase
Biological source	Mycobacterium tuberculosis
Total number of polymer chains	6
Total formula weight	176883.16
Authors	Kuo, M.R.,Morbidoni, H.R.,Alland, D.,Sneddon, S.F.,Gourlie, B.B.,Staveski, M.M.,Leonard, M.,Gregory, J.S.,Janjigian, A.D.,Yee, C.,Musser, J.M.,Kreiswirth, B.,Iwamoto, H.,Perozzo, R.,Jacobs Jr, W.R.,Sacchettini, J.C.,Fidock, D.A.,TB Structural Genomics Consortium (TBSGC) (deposition date: 2003-04-21, release date: 2003-09-16, Last modification date: 2024-02-14)
Primary citation	Kuo, M.R.,Morbidoni, H.R.,Alland, D.,Sneddon, S.F.,Gourlie, B.B.,Staveski, M.M.,Leonard, M.,Gregory, J.S.,Janjigian, A.D.,Yee, C.,Musser, J.M.,Kreiswirth, B.,Iwamoto, H.,Perozzo, R.,Jacobs, W.R.,Sacchettini, J.C.,Fidock, D.A. Targeting tuberculosis and malaria through inhibition of Enoyl reductase: compound activity and structural data. J.Biol.Chem., 278:20851-20859, 2003 Cited by PubMed: 12606558 DOI: 10.1074/jbc.M211968200 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.7 Å)

Structure validation