2XVL

crystal structure of alpha-xylosidase (GH31) from Cellvibrio japonicus in complex with Pentaerythritol propoxylate (5 4 PO OH)

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	ALPHA-XYLOSIDASE, PUTATIVE, XYL31A	polymer	1020	115203.9	1	UniProt (B3PBD9) Pfam (PF13802) Pfam (PF01055) Pfam (PF21365) Pfam (PF17137)	CELLVIBRIO JAPONICUS	ALPHA XYLOSIDASE
2	B, C, D (A)	NICKEL (II) ION	non-polymer		58.7	3	Chemie (NI)
3	E, F, G (A)	SULFATE ION	non-polymer		96.1	3	Chemie (SO4)
4	H, I, J, K, L... (A)	CHLORIDE ION	non-polymer		35.5	7	Chemie (CL)
5	N (A)	(2S)-1-[3-{[(2R)-2-hydroxypropyl]oxy}-2,2-bis({[(2R)-2-hydroxypropyl]oxy}methyl)propoxy]propan-2-ol	non-polymer		368.5	1	Chemie (PXN)
6	P (A)	water	water		18.0	714	Chemie (HOH)

Sequence modifications

A: 1 - 988 (UniProt: B3PBD9)

PDB	External Database	Details
Lys 989	-	expression tag
Val 990	-	expression tag
Val 991	-	expression tag
Ile 992	-	expression tag
Asn 993	-	expression tag
Ser 994	-	expression tag
Lys 995	-	expression tag
Leu 996	-	expression tag
Glu 997	-	expression tag
Gly 998	-	expression tag
Lys 999	-	expression tag
Pro 1000	-	expression tag
Ile 1001	-	expression tag
Pro 1002	-	expression tag
Asn 1003	-	expression tag
Pro 1004	-	expression tag
Leu 1005	-	expression tag
Leu 1006	-	expression tag
Gly 1007	-	expression tag
Leu 1008	-	expression tag
Asp 1009	-	expression tag
Ser 1010	-	expression tag
Thr 1011	-	expression tag
Arg 1012	-	expression tag
Thr 1013	-	expression tag
Gly 1014	-	expression tag
His 1015	-	expression tag
His 1016	-	expression tag
His 1017	-	expression tag
His 1018	-	expression tag
His 1019	-	expression tag
His 1020	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	115203.9
Non-Polymers*	Number of molecules	14
	Total formula weight	1080.9
All*	Total formula weight	116284.8

*Water molecules are not included.