MolNFT v2 · #155544 · protein
Crystal structure of PDE10A in complex with a triazolopyrimidine inhibitor
6KE0: “Crystal structure of PDE10A in complex with a triazolopyrimidine inhibitor”. X-ray diffraction at 2.95, 3 ligands (D7C, ZN, MG). MolNFT v2 #155544 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6KE0
- Type
- protein
- Length
- 648 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v2 / PDB Bank
- Contract
- 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
- Owner
- 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
- Resolution
- 2.95
- Source
- Homo sapiens
- UniProt
- Q9Y233
- Ligands
- D7C, ZN, MG
Structure
x-ray diffraction · resolution 2.95 · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | — | protein | 324 | — | Q9Y233 |
Ligands and binding sites
- D7C · 2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-[(2S)-2-methyl-1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl]ethanone · ligand · chains A
- ZN · Zinc ion · metal · 2 copies · chains A, B
- MG · Magnesium ion · metal · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6KE0 · Crystal structure of PDE10A in complex with a triazolopyrimidine inhibitor · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q9Y233
- Elsewhere: RCSB PDB 6KE0 · PDBe 6KE0 · UniProt Q9Y233
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