2C3J
Identification of a buried pocket for potent and selective inhibition of Chk1: prediction and verification
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 CHK1 | polymer | 297 | 34148.1 | 1 | UniProt (O14757) Pfam (PF00069) | HOMO SAPIENS (HUMAN) | CHK1 KINASE |
| 2 | B (A) | DEBROMOHYMENIALDISINE | non-polymer | 245.2 | 1 | Chemie (DBQ) | |||
| 3 | C (A) | SULFITE ION | non-polymer | 80.1 | 1 | Chemie (SO3) | |||
| 4 | D (A) | water | water | 18.0 | 219 | Chemie (HOH) |
Sequence modifications
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34148.1 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 325.3 | |
| All* | Total formula weight | 34473.4 |
