5HRS
HIV Integrase Catalytic Domain containing F185K + A124N + T125A mutations complexed with GSK0002
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Integrase | polymer | 164 | 17952.5 | 1 | UniProt (P04585) Pfam (PF00665) In PDB | Human immunodeficiency virus 1 (HIV-1) | |
| 2 | A | CACODYLATE ION | non-polymer | 137.0 | 2 | Chemie (CAC) | |||
| 3 | A | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
| 4 | A | 1,2-ETHANEDIOL | non-polymer | 62.1 | 1 | Chemie (EDO) | |||
| 5 | A | (2S)-tert-butoxy[1-(3,4-difluorobenzyl)-6-methyl-4-(5-methyl-3,4-dihydro-2H-chromen-6-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetic acid | non-polymer | 534.6 | 1 | Chemie (65P) | |||
| 6 | water | water | 18.0 | 95 | Chemie (HOH) |
Sequence modifications
A: 50 - 212 (UniProt: P04585)
| PDB | External Database | Details |
|---|---|---|
| Gly 49 | - | expression tag |
| Ser 123 | Gly 1270 | conflict |
| Asn 124 | Ala 1271 | engineered mutation |
| Ala 125 | Thr 1272 | engineered mutation |
| Lys 127 | Arg 1274 | conflict |
| Lys 185 | Phe 1332 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 17952.5 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 1062.8 | |
| All* | Total formula weight | 19015.3 |
