3QKM
Spirocyclic sulfonamides as AKT inhibitors
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | RAC-alpha serine/threonine-protein kinase | polymer | 341 | 39467.0 | 1 | UniProt (P31749) Pfam (PF00069) Pfam (PF00433) | Homo sapiens (human) | Protein kinase B, PKB, Proto-oncogene c-Akt, RAC-PK-alpha |
| 2 | B (A) | N-(2-ethoxyethyl)-N-{(2S)-2-hydroxy-3-[(5R)-2-(quinazolin-4-yl)-2,7-diazaspiro[4.5]dec-7-yl]propyl}-2,6-dimethylbenzenesulfonamide | non-polymer | 581.8 | 1 | Chemie (SM9) | |||
| 3 | C (A) | water | water | 18.0 | 308 | Chemie (HOH) |
Sequence modifications
A: 144 - 480 (UniProt: P31749)
| PDB | External Database | Details |
|---|---|---|
| Gly 140 | - | expression tag |
| Ala 141 | - | expression tag |
| Met 142 | - | expression tag |
| Ala 143 | - | expression tag |
| Asp 473 | Ser 473 | engineered mutation |
| Ser 478 | Gly 478 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 39467.0 | |
| Non-Polymers* | Number of molecules | 1 |
| Total formula weight | 581.8 | |
| All* | Total formula weight | 40048.7 |
