3NVS

1.02 Angstrom resolution crystal structure of 3-phosphoshikimate 1-carboxyvinyltransferase from Vibrio cholerae in complex with shikimate-3-phosphate (partially photolyzed) and glyphosate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	3-phosphoshikimate 1-carboxyvinyltransferase	polymer	450	48888.3	1	UniProt (Q9KRB0) Pfam (PF00275)	Vibrio cholerae	5-enolpyruvylshikimate-3-phosphate synthase, EPSP synthase, EPSPS
2	B (A)	SHIKIMATE-3-PHOSPHATE	non-polymer		254.1	1	Chemie (S3P)
3	C (A)	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID	non-polymer		174.2	1	Chemie (SKM)
4	D (A)	GLYPHOSATE	non-polymer		170.1	1	Chemie (GPJ)
5	E, F, G (A)	MAGNESIUM ION	non-polymer		24.3	3	Chemie (MG)
6	H, I, J, K (A)	CHLORIDE ION	non-polymer		35.5	4	Chemie (CL)
7	L (A)	4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID	non-polymer		238.3	1	Chemie (EPE)
8	M (A)	PHOSPHATE ION	non-polymer		95.0	1	Chemie (PO4)
9	N (A)	water	water		18.0	747	Chemie (HOH)

Sequence modifications

A: 1 - 426 (UniProt: Q9KRB0)

PDB	External Database	Details
Met -23	-	expression tag
His -22	-	expression tag
His -21	-	expression tag
His -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
Ser -16	-	expression tag
Ser -15	-	expression tag
Gly -14	-	expression tag
Val -13	-	expression tag
Asp -12	-	expression tag
Leu -11	-	expression tag
Gly -10	-	expression tag
Thr -9	-	expression tag
Glu -8	-	expression tag
Asn -7	-	expression tag
Leu -6	-	expression tag
Tyr -5	-	expression tag
Phe -4	-	expression tag
Gln -3	-	expression tag
Ser -2	-	expression tag
Asn -1	-	expression tag
Ala 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	48888.3
Non-Polymers*	Number of molecules	12
	Total formula weight	1146.4
All*	Total formula weight	50034.7

*Water molecules are not included.