7Q14

Acetyllysine73-incorporated OXA-48 complexed with imipenem and bromide ions in both active and inactive acyl-enzyme intermediates

This is a non-PDB format compatible entry.

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... (AAA, BBB, CCC, DDD, EEE...)	Beta-lactamase	polymer	260	30252.2	8	UniProt (A0A482LRD5) Pfam (PF00905)	Klebsiella pneumoniae
2	AA, DA, FA, I, JA... (EEE, FFF, GGG, AAA, HHH...)	Imipenem	non-polymer		301.4	8	Chemie (ID1)
3	BA, EA, GA, HA, J... (EEE, FFF, GGG, AAA, HHH...)	1-BUTANOL	non-polymer		74.1	12	Chemie (1BO)
4	CA, IA, L, M, MA... (EEE, GGG, AAA, HHH, BBB...)	BROMIDE ION	non-polymer		79.9	12	Chemie (BR)
5	OA, PA, QA, RA, SA... (AAA, BBB, CCC, DDD, EEE...)	water	water		18.0	516	Chemie (HOH)

Sequence modifications

AAA, BBB, CCC, DDD, EEE, FFF, GGG, HHH: 23 - 265 (UniProt: A0A482LRD5)

PDB	External Database	Details
Met 6	-	initiating methionine
His 7	-	expression tag
His 8	-	expression tag
His 9	-	expression tag
His 10	-	expression tag
His 11	-	expression tag
His 12	-	expression tag
Ser 13	-	expression tag
Ala 14	-	expression tag
Gly 15	-	expression tag
Glu 16	-	expression tag
Asn 17	-	expression tag
Leu 18	-	expression tag
Tyr 19	-	expression tag
Phe 20	-	expression tag
Gln 21	-	expression tag
Gly 22	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	242017.2
Non-Polymers*	Number of molecules	32
	Total formula weight	4259.2
All*	Total formula weight	246276.5

*Water molecules are not included.