5G53: Structure of the adenosine A2A receptor bound to an engineered G protein
X-ray · 3.40 Å · released 3 Aug 2016 · Homo sapiens
Related entries for the same target
same UniProt accessionLigands: NEC, SOG, GDP
How it was solved
- Method
- X-ray
- Resolution
- 3.40 Å
- Released
- 3 Aug 2016
- Rfree
- 0.315
- Rwork
- 0.284
- Clashscore
- 1.65
- Ramachandran outliers
- 0.22%
- Rotamer outliers
- 2.15%
Crystallisation
- pH
- 5.5
0.1 M NAOAC PH 5.5, 10% PEG 2000 (IN THE PRESENCE OF CHS); OR 0.1 M NAOAC PH 5.7, 9.5% PEG 2000 MME (IN THE ABSENCE OF CHS)
What is new
What it led to
GOBSMACKED: fold, dock, relax and annotate a protein-ligand complex, then grade it against the real crystal structure
Playbook · 15 Sep 2026
Primary citation
Structure of the Adenosine A2A Receptor Bound to an Engineered G Protein
Nature 2016
ADORA2A is the target of 2 approved drugs in ChEMBL.
Do it yourself
Field Guide: Xray and crystallisation
Unlocking Membrane Protein Structures: The Crystallization Revolution Reshaping Drug Discovery
Engineering Protein Stability: Unlocking the Secrets of Successful Crystallization
AXIS: Closing the Loop on Crystal Detection
Playbook
The Self-Driving Lab: How Automation and AI Are Redefining the Pace of Discovery
Tools
GOBSMACKED ↗
fold, dock, relax and annotate a protein-ligand complex on your own GPU, then find the crystal structure and g
CODSWALLOP ↗
every PDB entry for a protein family in one place: what was actually made, what it bound, what crystallised, a
TopPDBLX ↗
every crystallisation condition in the protein data bank, parsed and indexed: what worked, how often, and how
FlexAppeal ↗
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BoltzMaker ↗
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