5ZJ6
Crystal structure of HCK kinase complexed with a pyrrolo-pyrimidine inhibitor 7-[trans-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
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) | Tyrosine-protein kinase HCK | polymer | 287 | 32602.5 | 2 | UniProt (P08631) Pfam (PF07714) | Homo sapiens (Human) | Hematopoietic cell kinase,Hemopoietic cell kinase,p59-HCK/p60-HCK,p59Hck,p61Hck |
| 2 | C, D (A, B) | 7-[trans-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine | non-polymer | 482.6 | 2 | Chemie (VSE) | |||
| 3 | E, F (A, B) | water | water | 18.0 | 676 | Chemie (HOH) |
Sequence modifications
A, B: 247 - 526 (UniProt: P08631)
| PDB | External Database | Details |
|---|---|---|
| Gly 240 | - | expression tag |
| Ser 241 | - | expression tag |
| Ser 242 | - | expression tag |
| Gly 243 | - | expression tag |
| Ser 244 | - | expression tag |
| Ser 245 | - | expression tag |
| Gly 246 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 65205.1 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 965.2 | |
| All* | Total formula weight | 66170.3 |
