5GTD

o-Succinylbenzoate CoA Synthetase (MenE) from Bacillus Subtilis in Complex with the Acyl-adenylate Intermediate OSB-AMP

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)	2-succinylbenzoate--CoA ligase	polymer	494	55269.1	2	UniProt (P23971) Pfam (PF00501) Pfam (PF13193)	Bacillus subtilis (strain 168)	o-succinylbenzoyl-CoA synthetase,OSB-CoA synthetase
2	C, D, E, I (A, B)	CHLORIDE ION	non-polymer		35.5	4	Chemie (CL)
3	F (A)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
4	G, L (A, B)	ADENOSINE MONOPHOSPHATE	non-polymer		347.2	2	Chemie (AMP)
5	H, M (A, B)	2-SUCCINYLBENZOATE	non-polymer		222.2	2	Chemie (OSB)
6	J (B)	MAGNESIUM ION	non-polymer		24.3	1	Chemie (MG)
7	K (B)	IMIDAZOLE	non-polymer		69.1	1	Chemie (IMD)
8	N, O (A, B)	water	water		18.0	39	Chemie (HOH)

Sequence modifications

A, B: 1 - 486 (UniProt: P23971)

PDB	External Database	Details
Met -1	-	initiating methionine
Gly 0	-	expression tag
His 487	-	expression tag
His 488	-	expression tag
His 489	-	expression tag
His 490	-	expression tag
His 491	-	expression tag
His 492	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	110538.2
Non-Polymers*	Number of molecules	11
	Total formula weight	1480.2
All*	Total formula weight	112018.4

*Water molecules are not included.