9BFD

Tyrocidine synthetase modules 1 and 2 crosslinked in the condensation state, complex A

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Tyrocidine synthase 1	polymer	1098	124062.9	1	UniProt (P09095)	Brevibacillus parabrevis	Tyrocidine synthase I
2	B (B)	Tyrocidine synthase 2	polymer	1052	119776.0	1	UniProt (O30408)	Brevibacillus parabrevis	Tyrocidine synthase II
3	C (A)	(7S,10aR)-1-methyl-4-{4-[(5R)-1,1,5-trihydroxy-4,4-dimethyl-1,6,11-trioxo-2-oxa-7,10-diaza-1lambda~5~-phosphadodecan-12-yl]phenyl}-3,5,6,7,8,9,10,10a-octahydrocycloocta[d]pyridazin-7-yl [2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]carbamate	non-polymer		947.9	1	Chemie (A1AN1)
4	D (B)	5'-O-[(R)-hydroxy{[(2S)-pyrrolidin-2-ylcarbonyl]oxy}phosphoryl]adenosine	non-polymer		444.3	1	Chemie (PR8)

Sequence modifications

A: 3 - 1085 (UniProt: P09095)

PDB	External Database	Details
Met 1	-	expression tag
Val 2	-	expression tag
Arg 1086	-	expression tag
Leu 1087	-	expression tag
Arg 1088	-	expression tag
Gly 1089	-	expression tag
Ser 1090	-	expression tag
Arg 1091	-	expression tag
Ser 1092	-	expression tag
His 1093	-	expression tag
His 1094	-	expression tag
His 1095	-	expression tag
His 1096	-	expression tag
His 1097	-	expression tag
His 1098	-	expression tag

B: 3 - 1044 (UniProt: O30408)

PDB	External Database	Details
Met 1	-	expression tag
Gly 2	-	expression tag
Arg 850	Leu 850	conflict
Leu 1045	-	expression tag
Glu 1046	-	expression tag
His 1047	-	expression tag
His 1048	-	expression tag
His 1049	-	expression tag
His 1050	-	expression tag
His 1051	-	expression tag
His 1052	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	243838.9
Non-Polymers*	Number of molecules	2
	Total formula weight	1392.2
All*	Total formula weight	245231.1

*Water molecules are not included.