8QQ9

human carbonic anhydrase I in complex with 1-benzyl-3-(1-hydroxy-3,4-dihydro-1H-benzo[c][1,2]oxaborinin-7-yl)thiourea

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (AAA, BBB)	Carbonic anhydrase 1	polymer	261	28906.2	2	UniProt (P00915) Pfam (PF00194)	Homo sapiens (human)	Carbonate dehydratase I,Carbonic anhydrase B,CAB,Carbonic anhydrase I,CA-I
2	C, E (AAA, BBB)	ZINC ION	non-polymer		65.4	2	Chemie (ZN)
3	D, F (AAA, BBB)	1-[1,1-bis(oxidanyl)-3,4-dihydro-2,1$l^{4}-benzoxaborinin-7-yl]-3-(phenylmethyl)thiourea	non-polymer		329.2	2	Chemie (WHK)
4	G, H (AAA, BBB)	water	water		18.0	98	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	57812.4
Non-Polymers*	Number of molecules	4
	Total formula weight	789.2
All*	Total formula weight	58601.6

*Water molecules are not included.