3V6S
Discovery of potent and selective covalent inhibitors of JNK
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) | Mitogen-activated protein kinase 10 | polymer | 364 | 42059.7 | 2 | UniProt (P53779) Pfam (PF00069) | Homo sapiens (human) | MAP kinase 10, MAPK 10, MAP kinase p49 3F12, Stress-activated protein kinase 1b, SAPK1b, Stress-activated protein kinase JNK3, c-Jun N-terminal kinase 3 |
| 2 | C, D (A, B) | 3-{[4-(dimethylamino)butanoyl]amino}-N-(4-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}phenyl)benzamide | non-polymer | 495.6 | 2 | Chemie (0F0) | |||
| 3 | E, F (A, B) | water | water | 18.0 | 215 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 84119.4 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 991.2 | |
| All* | Total formula weight | 85110.5 |
