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PDBe Entry: 1lxc view

Crystal Structure of E. Coli Enoyl Reductase-NAD+ with a Bound Acrylamide Inhibitor
Summary
Header OXIDOREDUCTASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.4 Å, R-factor: 19.9%, Free R-factor: 25.3%, Spacegroup: P 61 2 2
Released 04/09/2002, deposition: 05/06/2002, last revision: 24/02/2009
Authors Miller, W.H.search; Seefeld, M.A.search; Newlander, K.A.search; Uzinskas, I.N.search; Burgess, W.J.search; Heerding, D.A.search; Yuan, C.C.K.search; Head, M.S.search; Payne, D.J.search; Rittenhouse, S.F.search; Moore, T.D.search; Pearson, S.C.search; Dewolf, V.search; Berry, W.E.search; Keller, P.M.search; Polizzi, B.J.search; Qiu, X.search; Janson, C.A.search; Huffman, W.F.search
Primary citation Discovery of aminopyridine-based inhibitors of bacterial enoyl-ACP reductase (FabI).
J.MED.CHEM.search vol:45, pag:3246-3256 (2002) [PubMed ID 12109908 ]search
Keywords FABIsearch, ENOYL REDUCTASEsearch, OXIDOREDUCTASEsearch
EC 1.3.1.9 ExPASy BRENDA search (A B)
Organism Escherichia coli 562search(A B)
UniProt Enoyl-[acyl-carrier-protein] reductase [NADH] (EC 1.3.1.9) (NADH-dependent enoyl-ACP reductase) P0AEK4search (A B)
Solvent A, B
Related entries 1c14, 1i2z, 1i30, 1qg6, 1lx6
Polymers
Id Name Type UniProt Residues Observed
A, B ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH] Protein P0AEK4 (FABI_ECOLI)search
262 95%
Heterogens
Id Name Ligands
A, B NICOTINAMIDE-ADENINE-DINUCLEOTIDE NAD search
A, B 3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE AYM search
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