7D0T

Structure of the CYP102A1 Haem Domain with N-Carboxybenzyl-L-Prolyl-L-Phenylalanine in complex with (S)-1-Indanylamine

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, L (A, B)	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	2	Chemie (HEM)
3	D, M (A, B)	(2S)-3-phenyl-2-[[(2S)-1-phenylmethoxycarbonylpyrrolidin-2-yl]carbonylamino]propanoic acid	non-polymer		396.4	2	Chemie (ZP6)
4	E, N (A, B)	(1~{S})-2,3-dihydro-1~{H}-inden-1-amine	non-polymer		133.2	2	Chemie (GQR)
5	F, G, H, I, J... (A, B)	GLYCEROL	non-polymer		92.1	9	Chemie (GOL)
6	R, S (A, B)	water	water		18.0	572	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	104601.3
Non-Polymers*	Number of molecules	15
	Total formula weight	3121.1
All*	Total formula weight	107722.4

*Water molecules are not included.