5DIA
PIM1 in complex with Cpd36 ((1S,3S)-N1-(6-(5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl)pyridin-2-yl)cyclohexane-1,3-diamine)
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 | 299 | 34447.1 | 1 | UniProt (P11309) Pfam (PF00069) | Homo sapiens (Human) | |
| 2 | B (A) | (1S,3S)-N-{6-[5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]pyridin-2-yl}cyclohexane-1,3-diamine | non-polymer | 385.5 | 1 | Chemie (5E6) | |||
| 3 | C (A) | water | water | 18.0 | 219 | Chemie (HOH) |
Sequence modifications
A: 29 - 313 (UniProt: P11309)
| PDB | External Database | Details |
|---|---|---|
| Met 28 | - | initiating methionine |
| Lys 314 | - | expression tag |
| Leu 315 | - | expression tag |
| Ala 316 | - | expression tag |
| Ala 317 | - | expression tag |
| Ala 318 | - | expression tag |
| Leu 319 | - | expression tag |
| Glu 320 | - | expression tag |
| His 321 | - | expression tag |
| His 322 | - | expression tag |
| His 323 | - | expression tag |
| His 324 | - | expression tag |
| His 325 | - | expression tag |
| His 326 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34447.1 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 385.5 | |
| All* | Total formula weight | 34832.6 |
