9GJY

Bacillus licheniformis nitroreductase

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... (A, B, C, D, E...)	NADH-dependent nitro/flavin oxidoreductase	polymer	248	28515.4	6	UniProt (Q65MG6) Pfam (PF00881)	Bacillus licheniformis
2	AA, CA, G, JA, O... (D, E, A, F, B...)	FLAVIN MONONUCLEOTIDE	non-polymer		456.3	6	Chemie (FMN)
3	BA, H, P (D, A, B)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	3	Chemie (PEG)
4	EA, I, J, K, M... (E, A, B, C)	1,2-ETHANEDIOL	non-polymer		62.1	9	Chemie (EDO)
5	GA, HA, L, X, Y (E, F, A, C)	ACETATE ION	non-polymer		59.0	5	Chemie (ACT)
6	FA, IA, KA, N, W... (E, F, B, C, D)	GLYCEROL	non-polymer		92.1	6	Chemie (GOL)
7	T (B)	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
8	DA, LA (E, F)	TRIETHYLENE GLYCOL	non-polymer		150.2	2	Chemie (PGE)
9	MA, NA, OA, PA, QA... (A, B, C, D, E...)	water	water		18.0	1125	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F: 1 - 227 (UniProt: Q65MG6)

PDB	External Database	Details
Met -20	-	initiating methionine
Gly -19	-	expression tag
Ser -18	-	expression tag
Ser -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
Ser -10	-	expression tag
Ser -9	-	expression tag
Gly -8	-	expression tag
Leu -7	-	expression tag
Val -6	-	expression tag
Pro -5	-	expression tag
Arg -4	-	expression tag
Gly -3	-	expression tag
Ser -2	-	expression tag
His -1	-	expression tag
Met 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	171092.3
Non-Polymers*	Number of molecules	32
	Total formula weight	4859.2
All*	Total formula weight	175951.6

*Water molecules are not included.