› 5olo

X-ray diffraction
3.1Å resolution

Structure of the A2A-StaR2-bRIL562-Tozadenant complex at 3.1A obtained from in meso soaking experiments.

Released:
DOI: 10.2210/pdb5olo/pdb
PDB entry 5olo coloured by chain, front view.
PDB entry 5olo coloured by chain, side view.
PDB entry 5olo coloured by chain, top view.
Source organisms:
Primary publication:
Towards high throughput GPCR crystallography: In Meso soaking of Adenosine A2A Receptor crystals.
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Doré AS
Sci Rep 8 41 (2018)
PMID: 29311713

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-142061 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Adenosine receptor A2a; Soluble cytochrome b562 Chain: A
Molecule details ›
Chain: A
Length: 434 amino acids
Theoretical weight: 48.07 KDa
Source organisms: Expression system: Trichoplusia ni
UniProt:
  • Canonical: P29274 (Residues: 2-208, 219-318; Coverage: 75%)
  • Canonical: P0ABE7 (Residues: 23-127; Coverage: 99%)
Gene names: ADORA2, ADORA2A, cybC
Sequence domains:

Ligands and Environments

5 bound ligands:
Ligand 9XW 1 x 9XW
Ligand CLR 3 x CLR
Ligand OLA 10 x OLA
Ligand OLC 8 x OLC
Ligand NA 1 x NA
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: DIAMOND BEAMLINE I24
Spacegroup: C2221
Unit cell:
a: 39.383Å b: 181.013Å c: 141.774Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.204 0.199 0.245
Expression system: Trichoplusia ni

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Citations

6 review citations

Targeting adenosine A2A receptor antagonism for treatment of cancer.
Congreve et al. (2018)
5 more

11 mentions without citation

International Union of Basic and Clinical Pharmacology. CXII: Adenosine Receptors: A Further Update.
IJzerman et al. (2022)
10 more