6JS8

Structure of the CYP102A1 Haem Domain with N-Dehydroabietoyl-L-Tryptophan

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)	Bifunctional cytochrome P450/NADPH--P450 reductase	polymer	456	52300.7	2	UniProt (P14779) Pfam (PF00067)	Bacillus megaterium	Cytochrome P450(BM-3),Cytochrome P450BM-3,Fatty acid monooxygenase,Flavocytochrome P450 BM3
2	C, O (A, B)	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	2	Chemie (HEM)
3	D, P (A, B)	DIMETHYL SULFOXIDE	non-polymer		78.1	2	Chemie (DMS)
4	E, Q (A, B)	(2S)-2-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid	non-polymer		486.6	2	Chemie (C5R)
5	AA, BA, F, G, H... (B, A)	GLYCEROL	non-polymer		92.1	20	Chemie (GOL)
6	CA, DA (A, B)	water	water		18.0	643	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	104601.3
Non-Polymers*	Number of molecules	26
	Total formula weight	4204.4
All*	Total formula weight	108805.7

*Water molecules are not included.