8C1H
Aurora A kinase in complex with TPX2-inhibitor 8
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Aurora kinase A | polymer | 265 | 30750.3 | 1 | UniProt (O14965) Pfam (PF00069) | Homo sapiens (human) | Aurora 2,Aurora/IPL1-related kinase 1,ARK-1,Aurora-related kinase 1,Breast tumor-amplified kinase,Ipl1- and aurora-related kinase 1,Serine/threonine-protein kinase 15,Serine/threonine-protein kinase 6,Serine/threonine-protein kinase Ayk1,Serine/threonine-protein kinase aurora-A |
| 2 | B (A) | 4-(4-chloranyl-3-pyrazin-2-yloxy-phenyl)-~{N}-(dimethylsulfamoyl)-7-methyl-1~{H}-indole-6-carboxamide | non-polymer | 485.9 | 1 | Chemie (T3U) | |||
| 3 | C (A) | ADENOSINE-5'-DIPHOSPHATE | non-polymer | 427.2 | 1 | Chemie (ADP) | |||
| 4 | D, E (A) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) | |||
| 5 | F (A) | (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid | non-polymer | 172.2 | 1 | Chemie (T5L) | |||
| 6 | G, H, I, J, K (A) | SULFATE ION | non-polymer | 96.1 | 5 | Chemie (SO4) | |||
| 7 | L, M (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 2 | Chemie (DMS) | |||
| 8 | N (A) | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
| 9 | O, P (A) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
| 10 | Q (A) | water | water | 18.0 | 77 | Chemie (HOH) |
Sequence modifications
A: 126 - 388 (UniProt: O14965)
| PDB | External Database | Details |
|---|---|---|
| Met 124 | - | initiating methionine |
| Gly 125 | - | expression tag |
| Ala 290 | Cys 290 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 30750.3 | |
| Non-Polymers* | Number of molecules | 15 |
| Total formula weight | 1900.5 | |
| All* | Total formula weight | 32650.8 |
