5J8X

CRYSTAL STRUCTURE OF E. COLI PBP5 WITH 2C

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	D-alanyl-D-alanine carboxypeptidase DacA	polymer	387	42483.2	1	UniProt (P0AEB2) Pfam (PF00768) Pfam (PF07943) In PDB	Escherichia coli	DD-peptidase,Beta-lactamase,Penicillin-binding protein 5,PBP-5
2	A	(4~{R})-4-[[4-(aminomethyl)phenyl]carbonylamino]-3,3-bis(oxidanyl)-2-oxa-3-boranuidabicyclo[4.4.0]deca-1(10),6,8-triene-10-carboxylic acid	non-polymer		357.1	1	Chemie (OK3)
3		water	water		18.0	27	Chemie (HOH)

Sequence modifications

A: 1 - 363 (UniProt: P0AEB2)

PDB	External Database	Details
Met -22	-	initiating methionine
Gly -21	-	expression tag
Ser -20	-	expression tag
Ser -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
Ser -12	-	expression tag
Ser -11	-	expression tag
Gly -10	-	expression tag
Leu -9	-	expression tag
Val -8	-	expression tag
Pro -7	-	expression tag
Arg -6	-	expression tag
Gly -5	-	expression tag
Ser -4	-	expression tag
His -3	-	expression tag
Met -2	-	expression tag
Ala -1	-	expression tag
Ser 0	-	expression tag
Cys 364	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	42483.2
Non-Polymers*	Number of molecules	1
	Total formula weight	357.1
All*	Total formula weight	42840.3

*Water molecules are not included.