4D42

Crystal structure of S. aureus FabI in complex with NADP and 4-fluoro- 5-hexyl-2-phenoxyphenol

Summary for 4D42

• Entry DOI: 10.2210/pdb4d42/pdb
• Related: 4D41 4D43 4D44 4D45 4D46
• Descriptor: ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH], GLUTAMIC ACID, 4-fluoro-5-hexyl-2-phenoxyphenol, ... (5 entities in total)
• Functional Keywords: short-chain dehydrogenase/reductase superfamily, fatty acid biosynthesis, lipid synthesis, safabi, fabi, oxidoreductase
• Biological source: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS N315
• Total number of polymer chains: 8
• Total formula weight: 258290.79

Authors

Schiebel, J.,Chang, A.,Tonge, P.J.,Sotriffer, C.A.,Kisker, C. (deposition date: 2014-10-26, release date: 2015-03-04, Last modification date: 2023-12-20)

• Primary citation: Schiebel, J.,Chang, A.,Merget, B.,Bommineni, G.R.,Yu, W.,Spagnuolo, L.A.,Baxter, M.V.,Tareilus, M.,Tonge, P.J.,Kisker, C.,Sotriffer, C.A.; An ordered water channel in Staphylococcus aureus FabI: unraveling the mechanism of substrate recognition and reduction.; Biochemistry, 54:1943-1955, 2015; PubMed: 25706582; DOI: 10.1021/bi5014358

Experimental method

X-RAY DIFFRACTION (2.02 Å)