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4ALK

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

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B, C, D, E...
(A, B, C, D, E...)
ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH]polymer28231144.28UniProt (Q7A6D8)STAPHYLOCOCCUS AUREUSENR
2BA, EA, I, L, O...
(G, H, A, B, C...)
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATEnon-polymer743.48Chemie (NAP)
3CA, FA, J, M, P...
(G, H, A, B, C...)
5-ETHYL-2-PHENOXYPHENOLnon-polymer214.38Chemie (E9P)
4AA, DA, K, N, Q...
(F, G, A, B, C...)
GLUTAMIC ACIDnon-polymer147.18Chemie (GLU)
5GA, HA, IA, JA, KA...
(A, B, C, D, E...)
waterwater18.01391Chemie (HOH)
Sequence modifications
A, B, C, D, E, F, G, H: 1 - 256 (UniProt: Q7A6D8)
PDBExternal DatabaseDetails
Met -25-expression tag
Lys -24-expression tag
His -23-expression tag
His -22-expression tag
His -21-expression tag
His -20-expression tag
His -19-expression tag
His -18-expression tag
Pro -17-expression tag
Met -16-expression tag
Ser -15-expression tag
Asp -14-expression tag
Tyr -13-expression tag
Asp -12-expression tag
Ile -11-expression tag
Pro -10-expression tag
Thr -9-expression tag
Thr -8-expression tag
Glu -7-expression tag
Asn -6-expression tag
Leu -5-expression tag
Tyr -4-expression tag
Phe -3-expression tag
Gln -2-expression tag
Gly -1-expression tag
Ala 0-expression tag
Val 2Leu 2engineered mutation
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains8
Total formula weight249153.9
Non-Polymers*Number of molecules24
Total formula weight8838.4
All*Total formula weight257992.3
*Water molecules are not included.

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PDB entries from 2025-07-30

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