6YYK
Crystal Structure of 1,5-dimethylindoline-2,3-dione covalently bound to the PH domain of Bruton's tyrosine kinase mutant R28C
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 BTK | polymer | 169 | 19929.0 | 2 | UniProt (Q06187) Pfam (PF00169) Pfam (PF00779) | Homo sapiens (Human) | Agammaglobulinemia tyrosine kinase,ATK,B-cell progenitor kinase,BPK,Bruton tyrosine kinase |
| 2 | C, E (A, B) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 3 | D, F (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) | |||
| 4 | G (B) | 1,5-dimethyl-3~{H}-indol-2-one | non-polymer | 161.2 | 1 | Chemie (IS7) | |||
| 5 | H, I (A, B) | water | water | 18.0 | 30 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 170 (UniProt: Q06187)
| PDB | External Database | Details |
|---|---|---|
| Cys 28 | Arg 28 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 39857.9 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 340.6 | |
| All* | Total formula weight | 40198.6 |
