5IFL

Crystal structure of B. pseudomallei FabI in complex with NAD and triclosan

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D, E... (B, A, C, D, E...)	Enoyl-[acyl-carrier-protein] reductase [NADH]	polymer	276	29325.4	16	UniProt (A0A069B9A4) Pfam (PF13561) UniProt (by SIFTS) (A0A0H3HP34)	Burkholderia pseudomallei
2	AA, CA, EA, GA, IA... (F, G, H, I, J...)	TRICLOSAN	non-polymer		289.5	16	Chemie (TCL)
3	BA, DA, FA, HA, JA... (F, G, H, I, J...)	NICOTINAMIDE-ADENINE-DINUCLEOTIDE	non-polymer		663.4	16	Chemie (NAD)
4	AB, BB, CB, DB, EB... (E, F, G, H, I...)	water	water		18.0	569	Chemie (HOH)

Sequence modifications

B, A, C, D, E, F, G, H, I, J, K, L, M, N, O, P: 1 - 263 (UniProt: A0A069B9A4)

PDB	External Database	Details
Lys 264	-	expression tag
Leu 265	-	expression tag
Ala 266	-	expression tag
Ala 267	-	expression tag
Ala 268	-	expression tag
Leu 269	-	expression tag
Glu 270	-	expression tag
His 271	-	expression tag
His 272	-	expression tag
His 273	-	expression tag
His 274	-	expression tag
His 275	-	expression tag
His 276	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	16
	Total formula weight	469206.3
Non-Polymers*	Number of molecules	32
	Total formula weight	15247.5
All*	Total formula weight	484453.7

*Water molecules are not included.