7O5N

Crystal Structure of a Class D carbapenemase complexed with Avibactam

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 (AAA, BBB, CCC, DDD)	Beta-lactamase	polymer	260	30211.1	4	UniProt (Q6XEC0) Pfam (PF00905)	Klebsiella pneumoniae
2	E, F, L, M, Q (AAA, BBB, CCC)	1-BUTANOL	non-polymer		74.1	5	Chemie (1BO)
3	G, N, R, W (AAA, BBB, CCC, DDD)	(2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide	non-polymer		267.3	4	Chemie (NXL)
4	H, I, J, O, S... (AAA, BBB, CCC, DDD)	CHLORIDE ION	non-polymer		35.5	8	Chemie (CL)
5	K, P, V (BBB, CCC, DDD)	GLYCEROL	non-polymer		92.1	3	Chemie (GOL)
6	AA, BA, Y, Z (CCC, DDD, AAA, BBB)	water	water		18.0	691	Chemie (HOH)

Sequence modifications

AAA, BBB, CCC, DDD: 23 - 265 (UniProt: Q6XEC0)

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	4
	Total formula weight	120844.5
Non-Polymers*	Number of molecules	20
	Total formula weight	1999.6
All*	Total formula weight	122844.1

*Water molecules are not included.