4R20

Zebra fish cytochrome P450 17A2 with Abiraterone

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Cytochrome P450 family 17 polypeptide 2	polymer	486	54146.2	2	UniProt (A7U483) Pfam (PF00067)	Danio rerio (leopard danio zebra danio zebra fish)
2	C, H (A, B)	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	2	Chemie (HEM)
3	D, I (A, B)	Abiraterone	non-polymer		349.5	2	Chemie (AER)
4	E, F, G, J, K (A, B)	MERCURY (II) ION	non-polymer		200.6	5	Chemie (HG)
5	L, M (A, B)	water	water		18.0	14	Chemie (HOH)

Sequence modifications

A, B: 26 - 495 (UniProt: A7U483)

PDB	External Database	Details
Met 16	-	expression tag
Ala 17	-	expression tag
Lys 18	-	expression tag
Lys 19	-	expression tag
Thr 20	-	expression tag
Ser 21	-	expression tag
Ser 22	-	expression tag
Lys 23	-	expression tag
Gly 24	-	expression tag
Lys 25	-	expression tag
His 496	-	expression tag
His 497	-	expression tag
His 498	-	expression tag
His 499	-	expression tag
His 500	-	expression tag
His 501	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	108292.3
Non-Polymers*	Number of molecules	9
	Total formula weight	2934.9
All*	Total formula weight	111227.3

*Water molecules are not included.