3CSO

HCV Polymerase in complex with a 1,5 Benzodiazepine inhibitor

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)	RNA-directed RNA polymerase	polymer	581	64817.3	2	UniProt (O92972) Pfam (PF00998)	Hepatitis C virus isolate	HCV-J4 Polymerase
2	C, D (A, B)	(11S)-10-acetyl-11-[4-(benzyloxy)-3-chlorophenyl]-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one	non-polymer		501.0	2	Chemie (XNI)
3	E, F (A, B)	water	water		18.0	222	Chemie (HOH)

Sequence modifications

A, B: 1 - 570 (UniProt: O92972)

PDB	External Database	Details
Met -2	-	expression tag
Ala -1	-	expression tag
Ser 0	-	expression tag
Leu 571	-	expression tag
Glu 572	-	expression tag
His 573	-	expression tag
His 574	-	expression tag
His 575	-	expression tag
His 576	-	expression tag
His 577	-	expression tag
His 578	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	129634.5
Non-Polymers*	Number of molecules	2
	Total formula weight	1002.0
All*	Total formula weight	130636.6

*Water molecules are not included.