4WRS
Crystal structure of human Pim-1 kinase in complex with an azaspiro pyrazinyl-indazole inhibitor.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Serine/threonine-protein kinase pim-1 | polymer | 286 | 33064.4 | 1 | UniProt (P11309) Pfam (PF00069) | Homo sapiens (Human) | |
| 2 | B, C (A) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 3 | D (A) | 3-{6-[(4R)-6-azaspiro[2.5]oct-4-yloxy]pyrazin-2-yl}-5-(2,6-difluorophenyl)-1H-indazole | non-polymer | 433.5 | 1 | Chemie (3U1) | |||
| 4 | E (A) | water | water | 18.0 | 142 | Chemie (HOH) |
Sequence modifications
A: 33 - 305 (UniProt: P11309)
| PDB | External Database | Details |
|---|---|---|
| Met 20 | - | initiating methionine |
| Ala 21 | - | expression tag |
| His 22 | - | expression tag |
| His 23 | - | expression tag |
| His 24 | - | expression tag |
| His 25 | - | expression tag |
| His 26 | - | expression tag |
| His 27 | - | expression tag |
| Asp 28 | - | expression tag |
| Glu 29 | - | expression tag |
| Val 30 | - | expression tag |
| Asp 31 | - | expression tag |
| Gly 32 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 33064.4 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 617.6 | |
| All* | Total formula weight | 33682.1 |
