2HB3
Wild-type HIV-1 Protease in complex with potent inhibitor GRL06579
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Protease | polymer | 99 | 10740.7 | 2 | UniProt (P03366) Pfam (PF00077) UniProt (by SIFTS) (Q7SSI0) In PDB | Human immunodeficiency virus 1 | |
2 | A, B | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
3 | A, B | SODIUM ION | non-polymer | 23.0 | 2 | Chemie (NA) | |||
4 | B | (3AS,5R,6AR)-HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL (2S,3S)-3-HYDROXY-4-(4-(HYDROXYMETHYL)-N-ISOBUTYLPHENYLSULFONAMIDO)-1-PHENYLBUTAN-2-YLCARBAMATE | non-polymer | 560.7 | 1 | Chemie (GRL) | |||
5 | B | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
6 | water | water | 18.0 | 205 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 99 (UniProt: P03366)
PDB | External Database | Details |
---|---|---|
Lys 7 | Gln 506 | engineered mutation |
Ile 33 | Leu 532 | engineered mutation |
Ile 63 | Leu 562 | engineered mutation |
Ala 67 | Cys 566 | engineered mutation |
Ala 95 | Cys 594 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 21481.4 | |
Non-Polymers* | Number of molecules | 7 |
Total formula weight | 805.1 | |
All* | Total formula weight | 22286.5 |