MolNFT v1 · #81684 · protein
Thermostabilised adenosine A2A receptor in complex with 6-(2,6- dimethylpyridin-4-yl)-5-phenyl-1,2,4-triazin-3-amine
3UZA · Adenosine receptor A2A: “Thermostabilised adenosine A2A receptor in complex with 6-(2,6…”. X-ray diffraction, 1 ligand (T4G), 3 pockets (best druggability 0.74). MolNFT v1 #81684 on GenesisL1: 3D structure, binding sites and pockets…
- PDB
- 3UZA
- Type
- protein
- Length
- 291 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Adenosine receptor A2A
- UniProt
- P29274
- Ligands
- T4G
- Pockets
- 3 · best druggability 0.74
Structure
x-ray diffraction · 1 distinct chain · 82% helix, 2% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Adenosine receptor A2A | protein | 291 | 82% helix, 2% strand | P29274 |
Ligands and binding sites
- T4G · 6-(2,6-dimethylpyridin-4-yl)-5-phenyl-1,2,4-triazin-3-amine · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 390 | 0.74 | 0.84 | 42 | T4G |
| 2 | 254 | 0.61 | 0.80 | 25 | empty |
| 3 | 73 | 0.39 | 0.78 | 15 | empty |
Modifications
Observed in the structure: 4 disulfide (disulfide).
Compared structures
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 P29274
- Elsewhere: RCSB PDB 3UZA · PDBe 3UZA · UniProt P29274
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