3EKR
Dihydroxylphenyl amides as inhibitors of the Hsp90 molecular chaperone
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) | Heat shock protein HSP 90-alpha | polymer | 226 | 25582.8 | 2 | UniProt (P07900) Pfam (PF13589) | Homo sapiens | HSP 86, Renal carcinoma antigen NY-REN-38 |
| 2 | C, E (A, B) | 4-{[(2R)-2-(2-methylphenyl)pyrrolidin-1-yl]carbonyl}benzene-1,3-diol | non-polymer | 297.3 | 2 | Chemie (PY9) | |||
| 3 | D (B) | PHOSPHATE ION | non-polymer | 95.0 | 1 | Chemie (PO4) | |||
| 4 | F, G (A, B) | water | water | 18.0 | 266 | Chemie (HOH) |
Sequence modifications
A, B: 9 - 225 (UniProt: P07900)
| PDB | External Database | Details |
|---|---|---|
| Met 8 | - | expression tag |
| Leu 226 | - | expression tag |
| Glu 227 | - | expression tag |
| His 228 | - | expression tag |
| His 229 | - | expression tag |
| His 230 | - | expression tag |
| His 231 | - | expression tag |
| His 232 | - | expression tag |
| His 233 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 51165.7 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 689.7 | |
| All* | Total formula weight | 51855.4 |
