6HM2

Structure in P1 form of the PBP AgtB in complex with agropinic acid from A.tumefacien R10

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 (A, B, C, D, E)	Agropine permease	polymer	341	37291.9	5	UniProt (W8FRA6)	Agrobacterium tumefaciens LBA4213 (Ach5)
2	F, J, N, R, W (A, B, C, D, E)	agropinic acid	non-polymer		291.3	5	Chemie (G9Z)
3	G, H, K, L, O... (A, B, C, D)	1,2-ETHANEDIOL	non-polymer		62.1	9	Chemie (EDO)
4	I, M, Q, V (A, B, C, D)	SODIUM ION	non-polymer		23.0	4	Chemie (NA)
5	AA, BA, X, Y, Z (D, E, A, B, C)	water	water		18.0	1019	Chemie (HOH)

Sequence modifications

A, B, C, D, E: 30 - 342 (UniProt: W8FRA6)

PDB	External Database	Details
Met 8	-	initiating methionine
Gly 9	-	expression tag
Ser 10	-	expression tag
Ser 11	-	expression tag
His 12	-	expression tag
His 13	-	expression tag
His 14	-	expression tag
His 15	-	expression tag
His 16	-	expression tag
His 17	-	expression tag
Ser 18	-	expression tag
Ser 19	-	expression tag
Gly 20	-	expression tag
Leu 21	-	expression tag
Val 22	-	expression tag
Pro 23	-	expression tag
Arg 24	-	expression tag
Gly 25	-	expression tag
Ser 26	-	expression tag
His 27	-	expression tag
Met 28	-	expression tag
Met 29	-	expression tag
His 343	-	expression tag
His 344	-	expression tag
His 345	-	expression tag
His 346	-	expression tag
His 347	-	expression tag
His 348	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	5
	Total formula weight	186459.5
Non-Polymers*	Number of molecules	18
	Total formula weight	2106.8
All*	Total formula weight	188566.3

*Water molecules are not included.