3P5R

Crystal Structure of Taxadiene Synthase from Pacific Yew (Taxus brevifolia) in complex with Mg2+ and 2-fluorogeranylgeranyl diphosphate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Taxadiene synthase	polymer	764	87801.6	2	UniProt (Q41594) Pfam (PF01397) Pfam (PF03936) In PDB	Taxus brevifolia (Pacific yew)	Taxa-4(5),11(12)-diene synthase
2	A, B	MAGNESIUM ION	non-polymer		24.3	6	Chemie (MG)
3	A, B	(2Z,6E,10E)-2-fluoro-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl trihydrogen diphosphate	non-polymer		468.4	2	Chemie (FGG)
4		water	water		18.0	1206	Chemie (HOH)

Sequence modifications

A, B: 108 - 862 (UniProt: Q41594)

PDB	External Database	Details
Met 107	-	initiating methionine
Gly 863	-	expression tag
Ser 864	-	expression tag
His 865	-	expression tag
His 866	-	expression tag
His 867	-	expression tag
His 868	-	expression tag
His 869	-	expression tag
His 870	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	175603.3
Non-Polymers*	Number of molecules	8
	Total formula weight	1082.7
All*	Total formula weight	176685.9

*Water molecules are not included.