9HY8
Crystal structure of an allosteric inhibitor bound to human RIPK1 kinase domain
This is a non-PDB format compatible entry.
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) | Receptor-interacting serine/threonine-protein kinase 1 | polymer | 297 | 33669.9 | 2 | UniProt (Q13546) Pfam (PF07714) | Homo sapiens (human) | Cell death protein RIP,Receptor-interacting protein 1,RIP-1 |
| 2 | C (A) | 1-[2,5-bis(chloranyl)phenyl]carbonyl-~{N}-[(4-methylphenyl)methyl]piperidine-4-carboxamide | non-polymer | 405.3 | 1 | Chemie (A1IX7) | |||
| 3 | D, E, F, G, H... (A, B) | IODIDE ION | non-polymer | 126.9 | 6 | Chemie (IOD) | |||
| 4 | J (B) | N-[(1S)-1-(2-chloro-6-fluorophenyl)ethyl]-5-cyano-1-methyl-1H-pyrrole-2-carboxamide | non-polymer | 305.7 | 1 | Chemie (1HX) | |||
| 5 | K, L (A, B) | water | water | 18.0 | 11 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 294 (UniProt: Q13546)
| PDB | External Database | Details |
|---|---|---|
| Gly -2 | - | expression tag |
| Ser -1 | - | expression tag |
| Gly 0 | - | expression tag |
| Ala 34 | Cys 34 | conflict |
| Ala 127 | Cys 127 | conflict |
| Ala 233 | Cys 233 | conflict |
| Ala 240 | Cys 240 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 67339.8 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 1472.5 | |
| All* | Total formula weight | 68812.3 |
