3GGU
HIV PR drug resistant patient's variant in complex 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, B (A, B) | Protease | polymer | 99 | 10953.7 | 2 | UniProt (P03367) Pfam (PF00077) | Human immunodeficiency virus type 1 (BRU ISOLATE) | |
| 2 | C (B) | (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 (44400512) PubChem (44578485) PubChem (52949690) PubChem (23545473) PubChem (66725685) PubChem (3001874) PubChem (58330571) PubChem (89394603) PubChem (102206609) PubChem (6320435) PubChem (60170302) PubChem (125136514) PubChem (70329566) PubChem (89334570) PubChem (213039) PubChem (101897907) PubChem (102206607) PubChem (102206608) PubChem (118243427) PubChem (118243428) PubChem (118243429) PubChem (125136515) PubChem (6320436) PubChem (6320437) 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 | D, E (A, B) | water | water | 18.0 | 142 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 99 (UniProt: P03367)
| PDB | External Database | Details |
|---|---|---|
| Ile 10 | Leu 510 | engineered mutation |
| Val 13 | Ile 513 | engineered mutation |
| Glu 16 | Gly 516 | engineered mutation |
| Phe 33 | Leu 533 | engineered mutation |
| Leu 36 | Met 536 | engineered mutation |
| Thr 37 | Ser 537 | engineered mutation |
| Ser 39 | Pro 539 | engineered mutation |
| Arg 45 | Lys 545 | engineered mutation |
| Leu 46 | Met 546 | engineered mutation |
| Val 54 | Ile 554 | engineered mutation |
| Arg 55 | Lys 555 | engineered mutation |
| Val 62 | Ile 562 | engineered mutation |
| Pro 63 | Leu 563 | engineered mutation |
| Val 71 | Ala 571 | engineered mutation |
| Asp 73 | Gly 573 | engineered mutation |
| Thr 82 | Val 582 | engineered mutation |
| Val 84 | Ile 584 | engineered mutation |
| Val 89 | Leu 589 | engineered mutation |
| Met 90 | Leu 590 | engineered mutation |
| Leu 93 | Ile 593 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 21907.4 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 547.7 | |
| All* | Total formula weight | 22455.1 |
