8CIC: Crystal structure of stabilized A2A adenosine receptor A2AR-StaR2-bRIL in complex with clinical candidate Etrumadenant

PDB ID: 8CICDownload
MMDB ID: 230813
PDB Deposition Date: 2023/2/9
Updated in MMDB: 2024/10
Experimental Method:
x-ray diffraction
Resolution: 2.102  Å
Source Organism:
Similar Structures:
Biological Unit for 8CIC: monomeric; determined by author and by software (PISA)
Molecular Components in 8CIC
Label Count Molecule
Protein (1 molecule)
1
Adenosine Receptor A2a,soluble Cytochrome B562
(Gene symbol: ADORA2A)
Molecule annotation
Chemicals and Non-standard biopolymers (29 molecules)
1
1
SODIUM IONSODIUM ION
2
1
3-[2-azanyl-6-[1-[[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]methyl]-1,2,3-triazol-4-yl]pyrimidin-4-yl]-2-methyl-benzenecarbonitrile3-[2-azanyl-6-[1-[[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]methyl]-1,2,3-triazol-4-yl]pyrimidin-4-yl]-2-methyl-benzenecarbonitrile
3
4
CHOLESTEROLCHOLESTEROL
4
15
OLEIC ACIDOLEIC ACID
5
3
(2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate(2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
6
5
(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303