8W7G

Crystal structure of cytochrome P450 CYP161H12 from Amycolatopsis pretoriensis

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Pentalenolactone synthase	polymer	416	45772.3	1	UniProt (A0A1H5RFX8) Pfam (PF00067) In PDB	Amycolatopsis pretoriensis
2	A	PROTOPORPHYRIN IX CONTAINING FE	non-polymer		616.5	1	Chemie (HEM)
3		water	water		18.0	398	Chemie (HOH)

Sequence modifications

A: 1 - 404 (UniProt: A0A1H5RFX8)

PDB	External Database	Details
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Val 26	Thr 26	conflict
Glu 89	Asp 89	conflict
Asn 136	Thr 136	conflict
Ala 139	Glu 139	conflict
Leu 159	Met 159	conflict
Ala 165	Glu 165	conflict
His 169	Lys 169	conflict
Arg 179	Met 179	conflict
Glu 184	Ala 184	conflict
Lys 199	Gln 199	conflict
Leu 216	Met 216	conflict
Ser 232	Ala 232	conflict
Ala 235	Gly 235	conflict
Thr 236	Ala 236	conflict
Val 279	Ile 279	conflict
Ile 303	Val 303	conflict
Arg 309	Met 309	conflict
Val 316	Ile 316	conflict
Glu 384	Asp 384	conflict
Val 386	Ile 386	conflict
Asp 398	Glu 398	conflict
His 405	-	expression tag
His 406	-	expression tag
His 407	-	expression tag
His 408	-	expression tag
His 409	-	expression tag
His 410	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	45772.3
Non-Polymers*	Number of molecules	1
	Total formula weight	616.5
All*	Total formula weight	46388.8

*Water molecules are not included.