4NPT
Crystal Structure of HIV-1 Protease Multiple Mutant P51 Complexed with Darunavir
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Protease | polymer | 99 | 10785.7 | 1 | UniProt (O38896) | Human immunodeficiency virus 1 | |
| 2 | B (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 | 1 | 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 | C (A) | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) PubChem (753) | |||
| 4 | D (A) | water | water | 18.0 | 48 | Chemie (HOH) |
Sequence modifications
A: 1 - 99 (UniProt: O38896)
| PDB | External Database | Details |
|---|---|---|
| Lys 7 | Gln 7 | engineered mutation |
| Asn 25 | Asp 25 | engineered mutation |
| Ile 32 | Val 32 | engineered mutation |
| Phe 33 | Leu 33 | engineered mutation |
| Ser 37 | Asn 37 | engineered mutation |
| Met 54 | Val 54 | engineered mutation |
| Ala 67 | Cys 67 | engineered mutation |
| Lys 70 | Gln 70 | engineered mutation |
| Ile 82 | Ala 82 | engineered mutation |
| Val 84 | Ile 84 | engineered mutation |
| Ala 95 | Cys 95 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 10785.7 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 639.8 | |
| All* | Total formula weight | 11425.4 |
