9RJ2
Bub1 kinase domain in complex with covalent inhibitor BM047
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) | Mitotic checkpoint serine/threonine-protein kinase BUB1 | polymer | 364 | 41769.4 | 2 | UniProt (O43683) Pfam (PF00069) | Homo sapiens (human) | hBUB1,BUB1A |
| 2 | C, E (A, B) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) PubChem (753) | |||
| 3 | D, F (A, B) | (2~{R})-~{N}-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-prop-2-ynoxy-quinazolin-6-yl]-1-(2-fluoranylethanoyl)pyrrolidine-2-carboxamide | non-polymer | 499.9 | 2 | Chemie (A1JG6) | |||
| 4 | G, H (A, B) | water | water | 18.0 | 91 | Chemie (HOH) |
Sequence modifications
A, B: 725 - 1085 (UniProt: O43683)
| PDB | External Database | Details |
|---|---|---|
| Gly 722 | - | expression tag |
| Pro 723 | - | expression tag |
| Gly 724 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 83538.8 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1184.0 | |
| All* | Total formula weight | 84722.8 |
