5VCW
CRYSTAL STRUCTURE OF HUMAN MYT1 KINASE DOMAIN IN COMPLEX WITH Pelitinib
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) | Membrane-associated tyrosine- and threonine-specific cdc2-inhibitory kinase | polymer | 311 | 34498.1 | 2 | UniProt (Q99640) Pfam (PF00069) | Homo sapiens (Human) | Myt1 kinase |
| 2 | C, H (A, B) | (2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-3-cyano-7-ethoxyquinolin-6-yl}-4-(dimethylamino)but-2-enamide | non-polymer | 467.9 | 2 | Chemie (93J) | |||
| 3 | D, I, J, K, L (A, B) | SULFATE ION | non-polymer | 96.1 | 5 | Chemie (SO4) | |||
| 4 | E, F, G, M (A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 4 | Chemie (EDO) | |||
| 5 | N, O (A, B) | water | water | 18.0 | 52 | Chemie (HOH) |
Sequence modifications
A, B: 75 - 362 (UniProt: Q99640)
| PDB | External Database | Details |
|---|---|---|
| Met 52 | - | initiating methionine |
| His 53 | - | expression tag |
| His 54 | - | expression tag |
| His 55 | - | expression tag |
| His 56 | - | expression tag |
| His 57 | - | expression tag |
| His 58 | - | expression tag |
| Ser 59 | - | expression tag |
| Ser 60 | - | expression tag |
| Gly 61 | - | expression tag |
| Val 62 | - | expression tag |
| Asp 63 | - | expression tag |
| Leu 64 | - | expression tag |
| Gly 65 | - | expression tag |
| Thr 66 | - | expression tag |
| Glu 67 | - | expression tag |
| Asn 68 | - | expression tag |
| Leu 69 | - | expression tag |
| Tyr 70 | - | expression tag |
| Phe 71 | - | expression tag |
| Gln 72 | - | expression tag |
| Ser 73 | - | expression tag |
| Met 74 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 68996.3 | |
| Non-Polymers* | Number of molecules | 11 |
| Total formula weight | 1664.4 | |
| All* | Total formula weight | 70660.7 |
