3T4E

1.95 Angstrom Crystal Structure of Shikimate 5-dehydrogenase (AroE) from Salmonella enterica subsp. enterica serovar Typhimurium in Complex with NAD

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)	Quinate/shikimate dehydrogenase	polymer	312	34112.9	2	UniProt (Q8ZPR4) Pfam (PF08501) Pfam (PF18317)	Salmonella enterica subsp. enterica serovar Typhimurium	NAD-dependent shikimate 5-dehydrogenase 2
2	C, E (A, B)	NICOTINAMIDE-ADENINE-DINUCLEOTIDE	non-polymer		663.4	2	Chemie (NAD)
3	D, F (A, B)	PHOSPHATE ION	non-polymer		95.0	2	Chemie (PO4)
4	G, H (A, B)	water	water		18.0	582	Chemie (HOH)

Sequence modifications

A, B: 1 - 288 (UniProt: Q8ZPR4)

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	2
	Total formula weight	68225.8
Non-Polymers*	Number of molecules	4
	Total formula weight	1516.8
All*	Total formula weight	69742.6

*Water molecules are not included.