9INA

Crystal Structure of isophthalate dioxygenase from Comamonas testosteroni KF1

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Rieske (2Fe-2S) domain protein	polymer	447	50725.8	1	UniProt (B7WRK8)	Comamonas testosteroni KF-1	isophthalate dioxygenase
2	B (A)	FE (II) ION	non-polymer		55.8	1	Chemie (FE2)
3	C (A)	FE2/S2 (INORGANIC) CLUSTER	non-polymer		175.8	1	Chemie (FES)
4	D (A)	water	water		18.0	7	Chemie (HOH)

Sequence modifications

A: 1 - 424 (UniProt: B7WRK8)

PDB	External Database	Details
Met -22	-	initiating methionine
Gly -21	-	expression tag
Ser -20	-	expression tag
Ser -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
Ser -12	-	expression tag
Ser -11	-	expression tag
Glu -10	-	expression tag
Asn -9	-	expression tag
Leu -8	-	expression tag
Tyr -7	-	expression tag
Phe -6	-	expression tag
Gln -5	-	expression tag
Gly -4	-	expression tag
His -3	-	expression tag
Met -2	-	expression tag
Ala -1	-	expression tag
Ser 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	50725.8
Non-Polymers*	Number of molecules	2
	Total formula weight	231.7
All*	Total formula weight	50957.5

*Water molecules are not included.