6PY9

Crystal structure of red kidney bean purple acid phosphatase in complex with adenosine diphosphate metavanadate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, D, C	Fe(3+)-Zn(2+) purple acid phosphatase	polymer	459	52926.4	4	UniProt (P80366) Pfam (PF16656) Pfam (PF00149) Pfam (PF14008) In PDB	Phaseolus vulgaris (Kidney bean)	PAP,Iron(III)-zinc(II) purple acid phosphatase
2	E, F, G, H	alpha-L-fucopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)]2-acetamido-2-deoxy-beta-D-glucopyranose	branched		570.5	4	In PDB GlyTouCan (G11971MR)
3	D, A, B, C	ZINC ION	non-polymer		65.4	4	Chemie (ZN)
4	D, A, B, C	FE (III) ION	non-polymer		55.8	4	Chemie (FE)
5	D, A, B, C	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	11	Chemie (NAG)
6	A, C	ADP METAVANADATE	non-polymer		527.1	2	Chemie (AD9)
7	C, D, A, B	SULFATE ION	non-polymer		96.1	11	Chemie (SO4)
8	D, A, B	SODIUM ION	non-polymer		23.0	3	Chemie (NA)
9	A, C, D, B	1,2-ETHANEDIOL	non-polymer		62.1	32	Chemie (EDO)
10	B, A, C, D	GLYCEROL	non-polymer		92.1	13	Chemie (GOL)
11	B, A, C	TRIETHYLENE GLYCOL	non-polymer		150.2	4	Chemie (PGE)
12	B	[(2~{R},3~{R},4~{R},5~{S})-2-(5-azanylimidazol-1-yl)-4-[[bis(oxidanyl)-[tris(oxidanyl)vanadiooxy]vanadio]oxy-bis(oxidanyl)vanadio]oxy-5-[[bis(oxidanyl)-[tris(oxidanyl)vanadiooxy]vanadio]oxymethyl]oxolan-3-yl]oxy-tris(oxidanyl)vanadium	non-polymer		790.8	1	Chemie (P4J)
13	B	CHLORIDE ION	non-polymer		35.5	1	Chemie (CL)
14	C	CITRATE ANION	non-polymer		189.1	2	Chemie (FLC)
15		water	water		18.0	1301	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	211705.7
Branched	Number of molecules	4
	Total formula weight	2282.2
Non-Polymers*	Number of molecules	88
	Total formula weight	10086.8
All*	Total formula weight	224074.7

*Water molecules are not included.