4LL3

Structure of wild-type HIV protease in complex with darunavir

Replaces:  3QOZ

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)	Protease	polymer	99	10830.8	2	UniProt (Q9WFL7) Pfam (PF00077) UniProt (by SIFTS) (P03367)	Human immunodeficiency virus 1
2	C, D (A)	(3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE	non-polymer		547.7	2	Chemie (017) PubChem (213039) PubChem (23545473) PubChem (44400512) PubChem (44578485) PubChem (52949690) PubChem (58330571) PubChem (60170302) PubChem (70329566) PubChem (66725685) PubChem (3001874) PubChem (6320436) PubChem (6320437) PubChem (89334570) PubChem (89394603) PubChem (102206609) PubChem (6320435) PubChem (101897907) PubChem (125136514) PubChem (102206607) PubChem (102206608) PubChem (118243427) PubChem (118243428) PubChem (118243429) PubChem (125136515) PubChem (129010372) PubChem (131632443) PubChem (131667685) PubChem (134694394) PubChem (137704505) PubChem (137704865) PubChem (138631483) PubChem (138631484) PubChem (138631622) PubChem (144227995) PubChem (145507139) PubChem (147231834) PubChem (156183881) PubChem (156183911) PubChem (171370671)
3	E, F (A, B)	water	water		18.0	141	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	21661.6
Non-Polymers*	Number of molecules	2
	Total formula weight	1095.3
All*	Total formula weight	22756.9

*Water molecules are not included.