6COJ

Crystal structure of Rhodococcus jostii RHA1 IpdAB E105A COCHEA-COA complex

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Probable CoA-transferase alpha subunit	polymer	308	33735.2	1	UniProt (Q0S7P9) Pfam (PF01144) In PDB	Rhodococcus jostii (strain RHA1)
2	B	Probable CoA-transferase beta subunit	polymer	253	27538.0	1	UniProt (Q0S7Q0) In PDB	Rhodococcus jostii
3	A, B	SULFATE ION	non-polymer		96.1	3	Chemie (SO4)
4	B	S-{(3R,5R,9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5-dioxido-10,14-dioxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} (5R,10R)-7-hydroxy-10-methyl-2-oxo-1-oxaspiro[4.5]dec-6-ene-6-carbothioate (non-preferred name)	non-polymer		975.7	1	Chemie (F8G)
5		water	water		18.0	708	Chemie (HOH)

Sequence modifications

A: 2 - 296 (UniProt: Q0S7P9)

PDB	External Database	Details
Met -11	-	initiating methionine
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
His -6	-	expression tag
His -5	-	expression tag
Leu -4	-	expression tag
Val -3	-	expression tag
Pro -2	-	expression tag
Arg -1	-	expression tag
Gly 0	-	expression tag
Ser 1	-	expression tag
Ala 105	Glu 105	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	61273.2
Non-Polymers*	Number of molecules	4
	Total formula weight	1263.9
All*	Total formula weight	62537.2

*Water molecules are not included.