4ZEB

PBP AccA from A. tumefaciens C58 in complex with agrocinopine A

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	ABC transporter, substrate binding protein (Agrocinopines A and B)	polymer	499	57178.1	2	UniProt (Q7D2F4) Pfam (PF00496) UniProt (by SIFTS) (Q52012) In PDB	Agrobacterium tumefaciens (strain C58 / ATCC 33970)
2	C, D	alpha-D-gulopyranose-(1-2)-4-O-phosphono-beta-D-fructofuranose	branched		422.3	2	In PDB
3	A, B	alpha-L-arabinopyranose	non-polymer		150.1	2	Chemie (ARA)
4	A	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
5	B	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
6		water	water		18.0	528	Chemie (HOH)

Sequence modifications

A, B: 30 - 521 (UniProt: Q7D2F4)

PDB	External Database	Details
Met 29	-	initiating methionine
His 522	-	expression tag
His 523	-	expression tag
His 524	-	expression tag
His 525	-	expression tag
His 526	-	expression tag
His 527	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	114356.2
Branched	Number of molecules	2
	Total formula weight	844.6
Non-Polymers*	Number of molecules	4
	Total formula weight	468.4
All*	Total formula weight	115669.2

*Water molecules are not included.