5XK7

Crystal structure of Isosesquilavandulyl Diphosphate Synthase from Streptomyces sp. strain CNH-189 in complex with DMAPP

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 (A, B, C, D)	Undecaprenyl diphosphate synthase	polymer	232	26708.2	4	UniProt (M4T4U9)	Streptomyces sp. CNH189
2	E, J, N, S (A, B, C, D)	MAGNESIUM ION	non-polymer		24.3	4	Chemie (MG)
3	F, G, K, O, T (A, B, C, D)	PYROPHOSPHATE 2-	non-polymer		176.0	5	Chemie (POP)
4	H, M, Q, V (A, B, C, D)	2-(N-MORPHOLINO)-ETHANESULFONIC ACID	non-polymer		195.2	4	Chemie (MES)
5	I, R (A, C)	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
6	L, P, U (B, C, D)	DIMETHYLALLYL DIPHOSPHATE	non-polymer		246.1	3	Chemie (DMA)
7	W, X, Y, Z (A, B, C, D)	water	water		18.0	904	Chemie (HOH)

Sequence modifications

A, B, C, D: 1 - 217 (UniProt: M4T4U9)

PDB	External Database	Details
Met -14	-	expression tag
Ala -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
Val -6	-	expression tag
Asp -5	-	expression tag
Asp -4	-	expression tag
Asp -3	-	expression tag
Asp -2	-	expression tag
Lys -1	-	expression tag
Met 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	106832.9
Non-Polymers*	Number of molecules	18
	Total formula weight	2688.4
All*	Total formula weight	109521.2

*Water molecules are not included.