4A6C
Stereoselective Synthesis, X-ray Analysis, and Biological Evaluation of a New Class of Lactam Based HIV-1 Protease Inhibitors
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | POL PROTEIN | polymer | 99 | 10775.7 | 2 | UniProt (Q8Q3H0) Pfam (PF00077) UniProt (by SIFTS) (P35963) In PDB | HUMAN IMMUNODEFICIENCY VIRUS | PROTEASE |
| 2 | B | METHYL ((S)-1-(2-(3-((3S,4S)-3-BENZYL-4-HYDROXY-1-((1S,2R)-2-HYDROXY-2,3-DIHYDRO-1H-INDEN-1-YL)-2-OXOPYRROLIDIN-3-YL)PROPYL)-2-(4-(PYRIDIN-4-YL)BENZYL)HYDRAZINYL)-3,3-DIMETHYL-1-OXOBUTAN-2-YL)CARBAMATE | non-polymer | 733.9 | 1 | Chemie (QG9) | |||
| 3 | water | water | 18.0 | 158 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 99 (UniProt: Q8Q3H0)
| PDB | External Database | Details |
|---|---|---|
| Pro 63 | Leu 63 | conflict |
| Thr 82 | Val 82 | conflict |
| Val 84 | Ile 84 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 21551.3 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 733.9 | |
| All* | Total formula weight | 22285.2 |
