2VTJ
Identification of N-(4-piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H- pyrazole-3-carboxamide (AT7519), a Novel Cyclin Dependent Kinase Inhibitor Using Fragment-Based X-Ray Crystallography and Structure Based Drug Design
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | CELL DIVISION PROTEIN KINASE 2 | polymer | 298 | 33976.5 | 1 | UniProt (P24941) Pfam (PF00069) | HOMO SAPIENS (HUMAN) | P33 PROTEIN KINASE, CYCLIN DEPENDENT KINASE 2 |
| 2 | B (A) | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
| 3 | C (A) | 4-[(6-chloropyrazin-2-yl)amino]benzenesulfonamide | non-polymer | 284.7 | 1 | Chemie (LZ4) | |||
| 4 | D (A) | water | water | 18.0 | 160 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 33976.5 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 376.8 | |
| All* | Total formula weight | 34353.3 |
