Het-PDB Navi2 (PDB: 4D45)

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Ligands
Code	Name	Link
GLU	Glutamic acid	PoSSuM
NAP	Nadp nicotinamide-adenine-dinucleotide phosphate	PoSSuM
J47	5-bromo-2-(4-chloro-2-hydroxyphenoxy)benzonitrile	PoSSuM

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Download interaction data: 4D45

Code :

4D45 PDBj RCSB PDB PDBe

Header :

OXIDOREDUCTASE

Title :

Crystal structure of S. aureus FabI in complex with NADP and 5-bromo- 2-(4-chloro-2-hydroxyphenoxy)benzonitrile

Release Data :

2015-03-04

Compound :

mol_id	molecule	chains	synonym
1	ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH]	A,B,C,D,E,F,G,H	ENR, ENOYL-ACP REDUCTASE
	ec: 1.3.1.39, 1.3.1.10 mutation: YES

Source :

mol_id	organism_scientific	expression_system
1	STAPHYLOCOCCUS AUREUS SUBSP. AUREUS N315 (taxid:158879)	ESCHERICHIA COLI (taxid:469008)
	expression_system_strain: BL21(DE3) expression_system_plasmid: PETM-11

Authors :

Tareilus, M., Schiebel, J., Chang, A., Tonge, P.J., Sotriffer, C.A., Kisker, C.

Keywords :

ENOYL-ACP REDUCTASE, SHORT-CHAIN DEHYDROGENASE/REDUCTASE SUPERFAMILY, FATTY ACID BIOSYNTHESIS, LIPID SYNTHESIS, SAFABI, FABI, OXIDOREDUCTASE

Exp. method :

X-RAY DIFFRACTION ( 2.15 Å )

Citation :

An Ordered Water Channel in Staphylococcus Aureus Fabi: Unraveling the Mechanism of Substrate Recognition and Reduction.

Schiebel, J.,Chang, A.,Merget, B. et al.
(2015) Biochemistry 54 : 1943

PDB ID: 4D45