4YC8
C-Helix-Out Binding of Dasatinib Analog to c-Abl Kinase
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 ABL1 | polymer | 287 | 33223.0 | 2 | UniProt (P00519) Pfam (PF07714) | Homo sapiens (Human) | Abelson murine leukemia viral oncogene homolog 1,Abelson tyrosine-protein kinase 1,Proto-oncogene c-Abl,p150 |
| 2 | C, F (A, B) | 2-({6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl}amino)-N-(4-phenoxyphenyl)-1,3-thiazole-5-carboxamide | non-polymer | 531.6 | 2 | Chemie (4B7) | |||
| 3 | D, G (A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 2 | Chemie (EDO) | |||
| 4 | E, H (A, B) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 2 | Chemie (MES) | |||
| 5 | I, J (A, B) | water | water | 18.0 | 11 | Chemie (HOH) |
Sequence modifications
A, B: 229 - 512 (UniProt: P00519)
| PDB | External Database | Details |
|---|---|---|
| Gly 226 | - | expression tag |
| His 227 | - | expression tag |
| Met 228 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 66446.0 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 1577.9 | |
| All* | Total formula weight | 68023.8 |
