9GJX

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, G, IA, PA, R... (C, A, D, E, B...)	FLAVIN MONONUCLEOTIDE	non-polymer		456.3	6	Chemie (FMN)
3	CA, GA, H, K, P... (C, D, A, B, E)	GLYCEROL	non-polymer		92.1	9	Chemie (GOL)
4	AB, BA, BB, EA, I... (F, C, A, D, B...)	1,2-ETHANEDIOL	non-polymer		62.1	20	Chemie (EDO)
5	J, KA, TA, X (A, D, E, B)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	4	Chemie (PEG)
6	DA, HA, L, Q, VA (C, D, A, B, E)	5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE	non-polymer		252.2	5	Chemie (CB1)
7	FA, O, OA, Z (C, A, D, B)	SULFATE ION	non-polymer		96.1	4	Chemie (SO4)
8	CB, DB, EB, FB, GB... (A, B, C, D, E...)	water	water		18.0	373	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	48
	Total formula weight	6877.9
All*	Total formula weight	177970.2

*Water molecules are not included.