4YS7
Co-crystal structure of 2-[2-(5,8-dimethyl[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methyl-3H-imidazo[4,5-f]quinoline (compound 39) with PDE10A
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) | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | polymer | 322 | 37231.9 | 2 | UniProt (Q9Y233) | Homo sapiens (Human) | Phosphodiesterase 10A, PDE10A |
| 2 | C, F (A, B) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 3 | D, G (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) | |||
| 4 | E, H (A, B) | 2-[2-(5,8-dimethyl[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methyl-3H-imidazo[4,5-f]quinoline | non-polymer | 357.4 | 2 | Chemie (4GK) | |||
| 5 | I, J (A, B) | water | water | 18.0 | 22 | Chemie (HOH) |
Sequence modifications
A, B: 449 - 769 (UniProt: Q9Y233)
| PDB | External Database | Details |
|---|---|---|
| Ala 448 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 74463.8 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 894.3 | |
| All* | Total formula weight | 75358.0 |
