8P5K
Kinase domain of mutant human ULK1 in complex with compound MRT68921
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 (A, B, C, D) | Serine/threonine-protein kinase ULK1 | polymer | 284 | 32121.1 | 4 | UniProt (O75385) Pfam (PF00069) | Homo sapiens (human) | Autophagy-related protein 1 homolog,ATG1,hATG1,Unc-51-like kinase 1 |
| 2 | E, J, N, S (A, B, C, D) | ~{N}-[3-[[5-cyclopropyl-2-[(2-methyl-3,4-dihydro-1~{H}-isoquinolin-6-yl)amino]pyrimidin-4-yl]amino]propyl]cyclobutanecarboxamide | non-polymer | 434.6 | 4 | Chemie (HVH) | |||
| 3 | F, K, O (A, B, C) | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
| 4 | G, H, L, M, P... (A, B, C, D) | MAGNESIUM ION | non-polymer | 24.3 | 8 | Chemie (MG) | |||
| 5 | I, R (A, C) | PHOSPHATE ION | non-polymer | 95.0 | 2 | Chemie (PO4) | |||
| 6 | V, W, X, Y (A, B, C, D) | water | water | 18.0 | 617 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 283 (UniProt: O75385)
| PDB | External Database | Details |
|---|---|---|
| Ser 0 | - | expression tag |
| Ala 245 | Arg 245 | engineered mutation |
| Ala 246 | Glu 246 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 128484.4 | |
| Non-Polymers* | Number of molecules | 17 |
| Total formula weight | 2399.0 | |
| All* | Total formula weight | 130883.4 |
