6Q2A
Trypanosoma brucei CLK1 kinase domain in complex with a covalent aminobenzimidazole inhibitor AB1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D, E... (A, B, C, D, E...) | Protein kinase, putative | polymer | 354 | 41119.7 | 16 | UniProt (Q382U0) Pfam (PF00069) | Trypanosoma brucei brucei (strain 927/4 GUTat10.1) | |
| 2 | AA, AB, BB, CA, DA... (D, L, E, M, N...) | SULFATE ION | non-polymer | 96.1 | 33 | Chemie (SO4) | |||
| 3 | BA, CB, EB, FA, GB... (D, L, M, E, N...) | ~{N}-[1-[(3~{R})-1-[4-(dimethylamino)but-2-enoyl]azepan-3-yl]-7-methyl-benzimidazol-2-yl]-2-methyl-pyridine-4-carboxamide | non-polymer | 474.6 | 16 | Chemie (5XH) | |||
| 4 | AC, BC, CC, NB, OB... (N, O, P, A, B...) | water | water | 18.0 | 511 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P: 117 - 465 (UniProt: Q382U0)
| PDB | External Database | Details |
|---|---|---|
| Gly 112 | - | expression tag |
| Pro 113 | - | expression tag |
| Ser 114 | - | expression tag |
| Met 115 | - | expression tag |
| His 116 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 16 |
| Total formula weight | 657914.9 | |
| Non-Polymers* | Number of molecules | 49 |
| Total formula weight | 10763.6 | |
| All* | Total formula weight | 668678.5 |
