9ZO1

Crystal structure of deoxypodophyllotoxin synthase (DPS) complexed with vanadyl(IV)-oxo, succinate and (-)-hydroxy-yatein

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Deoxypodophyllotoxin synthase	polymer	318	36140.1	2	UniProt (A0A0N9HQ36)	Sinopodophyllum hexandrum	2-oxoglutarate dependent dioxygenase
2	C, K (A, B)	oxovanadium(2+)	non-polymer		66.9	2	Chemie (VVO) PubChem (34008)
3	D, I (A, B)	(3S,4S)-4-[(S)-(2H-1,3-benzodioxol-5-yl)(hydroxy)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one	non-polymer		416.4	2	Chemie (A1C3S)
4	E, J (A, B)	SUCCINIC ACID	non-polymer		118.1	2	Chemie (SIN) PubChem (1110)
5	F (A)	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
6	G, L, M (A, B)	GLYCEROL	non-polymer		92.1	3	Chemie (GOL) PubChem (753)
7	H, N (A, B)	CHLORIDE ION	non-polymer		35.5	2	Chemie (CL) PubChem (312)
8	O, P (A, B)	water	water		18.0	638	Chemie (HOH)

Sequence modifications

A, B: 1 - 310 (UniProt: A0A0N9HQ36)

PDB	External Database	Details
Leu 311	-	expression tag
Glu 312	-	expression tag
His 313	-	expression tag
His 314	-	expression tag
His 315	-	expression tag
His 316	-	expression tag
His 317	-	expression tag
His 318	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	72280.2
Non-Polymers*	Number of molecules	12
	Total formula weight	1612.2
All*	Total formula weight	73892.4

*Water molecules are not included.