7KM1

Dihydrodipicolinate synthase (DHDPS) from C.jejuni, H59N mutant with pyruvate bound in the active site and R,R-bislysine bound at the allosteric site

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, E... (A, B, C, D, E...)	4-hydroxy-tetrahydrodipicolinate synthase	polymer	310	34161.2	6	UniProt (Q9PPB4) Pfam (PF00701)	Campylobacter jejuni subsp. jejuni serotype O:2 (strain ATCC 700819 / NCTC 11168)	HTPA synthase
2	CA, CB, G, H, TA (C, F, A, E)	TETRAETHYLENE GLYCOL	non-polymer		194.2	5	Chemie (PG4)
3	DA, DB, I (C, F, A)	(2R,5R)-2,5-diamino-2,5-bis(4-aminobutyl)hexanedioic acid	non-polymer		318.4	3	Chemie (3VN)
4	EB, FB, GA, HA, IA... (F, C, A, D, B...)	1,2-ETHANEDIOL	non-polymer		62.1	18	Chemie (EDO)
5	JA, L, M, N, PA... (C, A, D, E)	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	6	Chemie (PEG)
6	AA, KA, O, P, QA... (B, C, A, D)	MAGNESIUM ION	non-polymer		24.3	7	Chemie (MG)
7	AB, BA, GB, HB, LA... (E, B, F, C, A...)	ACETATE ION	non-polymer		59.0	9	Chemie (ACT)
8	EA, FA, MA, S, UA (C, D, B, E)	TRIETHYLENE GLYCOL	non-polymer		150.2	5	Chemie (PGE)
9	BB, IB (E, F)	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
10	JB, KB, LB, MB, NB... (A, B, C, D, E...)	water	water		18.0	687	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F: 1 - 298 (UniProt: Q9PPB4)

PDB	External Database	Details
Met -11	-	expression tag
Arg -10	-	expression tag
Gly -9	-	expression tag
Ser -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag
Asn 59	His 59	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	204967.3
Non-Polymers*	Number of molecules	55
	Total formula weight	5316.9
All*	Total formula weight	210284.2

*Water molecules are not included.