5J9L
Crystal structure of CPT1691 bound to TAK1-TAB1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Mitogen-activated protein kinase kinase kinase 7,TGF-beta-activated kinase 1 and MAP3K7-binding protein 1 | polymer | 307 | 34781.1 | 1 | UniProt (O43318) UniProt (Q15750) Pfam (PF07714) | Homo sapiens (Human) | Transforming growth factor-beta-activated kinase 1,TGF-beta-activated kinase 1,Mitogen-activated protein kinase kinase kinase 7-interacting protein 1,TGF-beta-activated kinase 1-binding protein 1,TAK1-binding protein 1 |
| 2 | B (A) | N-(4-((2-((4-(4-methylpiperazin-1-yl)phenyl)amino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)oxy)phenyl)acrylamide | non-polymer | 469.5 | 1 | Chemie (6HF) | |||
| 3 | C (A) | water | water | 18.0 | 10 | Chemie (HOH) |
Sequence modifications
A: 31 - 303 (UniProt: O43318)
A: 468 - 497 (UniProt: Q15750)
| PDB | External Database | Details |
|---|---|---|
| Ser 27 | - | expression tag |
| Leu 28 | - | expression tag |
| His 29 | - | expression tag |
| Met 30 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34781.1 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 469.5 | |
| All* | Total formula weight | 35250.6 |
