9VD2
Crystal Structure of kelch domain of human KEAP1 in complex with CH7286675
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Kelch-like ECH-associated protein 1 | polymer | 293 | 31951.8 | 1 | UniProt (Q14145) | Homo sapiens (human) | Cytosolic inhibitor of Nrf2,INrf2,Kelch-like protein 19 |
| 2 | B (A) | 4-[3-[2,6-dichloro-4-(6-methoxy-2-azaspiro[3.3]heptan-2-yl)benzoyl]-2,4-dihydro-1,3-benzoxazin-8-yl]-5-fluoro-2-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)benzoic acid | non-polymer | 682.6 | 1 | Chemie (A1L99) | |||
| 3 | C, D, E, F, G... (A) | ACETATE ION | non-polymer | 59.0 | 8 | Chemie (ACT) | |||
| 4 | H, L, M, N (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 4 | Chemie (DMS) | |||
| 5 | O (A) | water | water | 18.0 | 300 | Chemie (HOH) |
Sequence modifications
A: 321 - 609 (UniProt: Q14145)
| PDB | External Database | Details |
|---|---|---|
| Gly 317 | - | expression tag |
| Ser 318 | - | expression tag |
| His 319 | - | expression tag |
| Met 320 | - | expression tag |
| Ala 540 | Glu 540 | engineered mutation |
| Ala 542 | Glu 542 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 31951.8 | |
| Non-Polymers* | Number of molecules | 13 |
| Total formula weight | 1467.4 | |
| All* | Total formula weight | 33419.2 |
