8K4R

Structure of VinM-VinL complex

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, C	Non-ribosomal peptide synthetase	polymer	540	58061.5	2	UniProt (Q76KY3) Pfam (PF00501) In PDB	Streptomyces halstedii	VinM
2	B, D	Acyl-carrier-protein	polymer	102	11788.1	2	UniProt (Q76KY4) Pfam (PF00550) In PDB	Streptomyces halstedii	VinL
3	A, C	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
4	B, D	[(3~{R})-4-[[3-(6-acetamidohexylamino)-3-oxidanylidene-propyl]amino]-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] dihydrogen phosphate	non-polymer		439.4	2	Chemie (VPI)
5		water	water		18.0	43	Chemie (HOH)

Sequence modifications

A, C: 1 - 524 (UniProt: Q76KY3)

PDB	External Database	Details
Met -15	-	initiating methionine
Asn -14	-	expression tag
His -13	-	expression tag
Lys -12	-	expression tag
Val -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
Ile -4	-	expression tag
Glu -3	-	expression tag
Gly -2	-	expression tag
Arg -1	-	expression tag
His 0	-	expression tag
Cys 223	Asp 223	engineered mutation

B, D: 1 - 82 (UniProt: Q76KY4)

PDB	External Database	Details
Met -19	-	initiating methionine
Gly -18	-	expression tag
Ser -17	-	expression tag
Ser -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
Ser -9	-	expression tag
Ser -8	-	expression tag
Gly -7	-	expression tag
Leu -6	-	expression tag
Val -5	-	expression tag
Pro -4	-	expression tag
Arg -3	-	expression tag
Gly -2	-	expression tag
Ser -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	139699.1
Non-Polymers*	Number of molecules	4
	Total formula weight	924.9
All*	Total formula weight	140624.0

*Water molecules are not included.