4CV3

Crystal structure of E. coli FabI in complex with NADH and PT166

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH]	polymer	270	28964.1	2	UniProt (C6EFU4)	ESCHERICHIA COLI	ENOYL-ACP REDUCTASE
2	C, E (A, B)	2-hexyl-1-methyl-5-(2-methylphenoxy)pyridin-4(1H)-one	non-polymer		299.4	2	Chemie (VT4)
3	D, F (A, B)	1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE	non-polymer		665.4	2	Chemie (NAI)
4	G, H (A, B)	water	water		18.0	246	Chemie (HOH)

Sequence modifications

A, B: 1 - 262 (UniProt: C6EFU4)

PDB	External Database	Details
Leu 263	-	expression tag
Glu 264	-	expression tag
His 265	-	expression tag
His 266	-	expression tag
His 267	-	expression tag
His 268	-	expression tag
His 269	-	expression tag
His 270	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	57928.1
Non-Polymers*	Number of molecules	4
	Total formula weight	1929.7
All*	Total formula weight	59857.8

*Water molecules are not included.