9O71

Hexameric Rieske non-heme iron dioxygenase

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Phenylpropionate dioxygenase-like ring-hydroxylating dioxygenase large terminal subunit	polymer	453	51366.8	1	UniProt (A0AAW8EQ13)	Variovorax paradoxus
2	B (B)	Aromatic-ring-hydroxylating dioxygenase beta subunit	polymer	162	18952.4	1	UniProt (C5CSP7)	Variovorax paradoxus
3	C (A)	FE2/S2 (INORGANIC) CLUSTER	non-polymer		175.8	1	Chemie (FES)
4	D (A)	FE (II) ION	non-polymer		55.8	1	Chemie (FE2) PubChem (27284)
5	E (B)	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
6	F, G (A, B)	water	water		18.0	777	Chemie (HOH)

Sequence modifications

A: 1 - 437 (UniProt: A0AAW8EQ13)

PDB	External Database	Details
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
Asn 94	Ser 94	engineered mutation
Gly 165	Asp 165	engineered mutation

B: 1 - 162 (UniProt: C5CSP7)

PDB	External Database	Details
Gln 97	Thr 97	engineered mutation
Val 106	Ala 106	engineered mutation
Leu 107	Val 107	engineered mutation
Arg 135	Gln 135	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	70319.2
Non-Polymers*	Number of molecules	3
	Total formula weight	293.7
All*	Total formula weight	70612.9

*Water molecules are not included.