3MS9
ABL kinase in complex with imatinib and a fragment (FRAG1) in the myristate pocket
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 | 293 | 33743.5 | 2 | UniProt (P00520) Pfam (PF07714) | Mus musculus (mouse) | Abelson murine leukemia viral oncogene homolog 1, Proto-oncogene c-Abl, p150 |
| 2 | C, I (A, B) | 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE | non-polymer | 493.6 | 2 | Chemie (STI) | |||
| 3 | D, J (A, B) | methyl 2-amino-4-chlorobenzoate | non-polymer | 185.6 | 2 | Chemie (MS9) | |||
| 4 | E, F, G, H, K... (A, B) | CHLORIDE ION | non-polymer | 35.5 | 6 | Chemie (CL) | |||
| 5 | M, N (A, B) | water | water | 18.0 | 443 | Chemie (HOH) |
Sequence modifications
A, B: 229 - 515 (UniProt: P00520)
| PDB | External Database | Details |
|---|---|---|
| Gly 223 | - | expression tag |
| Ala 224 | - | expression tag |
| Met 225 | - | expression tag |
| Asp 226 | - | expression tag |
| Pro 227 | - | expression tag |
| Ser 228 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 67487.0 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 1571.1 | |
| All* | Total formula weight | 69058.2 |
