7VVI

OXA-58 crystal structure of acylated meropenem complex

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Beta-lactamase	polymer	252	28778.9	1	UniProt (Q2TR58) Pfam (PF00905) In PDB	Acinetobacter baumannii
2	A	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
3	A	(4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid	non-polymer		385.5	1	Chemie (MER)
4		water	water		18.0	382	Chemie (HOH)

Sequence modifications

A: 44 - 280 (UniProt: Q2TR58)

PDB	External Database	Details
Met 29	-	initiating methionine
Asn 30	-	expression tag
His 31	-	expression tag
Lys 32	-	expression tag
Val 33	-	expression tag
His 34	-	expression tag
His 35	-	expression tag
His 36	-	expression tag
His 37	-	expression tag
His 38	-	expression tag
His 39	-	expression tag
Ile 40	-	expression tag
Glu 41	-	expression tag
Gly 42	-	expression tag
Arg 43	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	28778.9
Non-Polymers*	Number of molecules	2
	Total formula weight	481.5
All*	Total formula weight	29260.4

*Water molecules are not included.