5DF9

CRYSTAL STRUCTURE OF PENICILLIN-BINDING PROTEIN 3 IN COMPLEX WITH DEACYLATED PRODUCT OF CEFOPERAZONE

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Cell division protein	polymer	564	61152.6	1	UniProt (Q51504) Pfam (PF03717) Pfam (PF00905)	Pseudomonas aeruginosa	Penicillin-binding protein 3,Pseudomonas aeruginosa genome assembly PAE221
2	B, C (A)	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
3	D (A)	(2R,5R)-2-[(R)-carboxy{[(2R)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-2-(4-hydroxyphenyl)acetyl]amino}methyl]-5-methyl-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid	non-polymer		549.6	1	Chemie (59J)
4	E (A)	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
5	F (A)	water	water		18.0	21	Chemie (HOH)

Sequence modifications

A: 35 - 579 (UniProt: Q51504)

PDB	External Database	Details
Met 16	-	initiating methionine
Ala 17	-	expression tag
His 18	-	expression tag
His 19	-	expression tag
His 20	-	expression tag
His 21	-	expression tag
His 22	-	expression tag
His 23	-	expression tag
Ser 24	-	expression tag
Ser 25	-	expression tag
Gly 26	-	expression tag
Leu 27	-	expression tag
Glu 28	-	expression tag
Val 29	-	expression tag
Leu 30	-	expression tag
Phe 31	-	expression tag
Gln 32	-	expression tag
Gly 33	-	expression tag
Pro 34	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	61152.6
Non-Polymers*	Number of molecules	4
	Total formula weight	833.8
All*	Total formula weight	61986.4

*Water molecules are not included.