PDB
8RWE
Resolution
2.2 Å
Released
Jan. 8, 2025
Receptor
A2A
Class
A
Species
Homo sapiens
Ligand
CHEMBL2381766
Function
Antagonist
Reference
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Ligand Amino Acid Generic Number Segment Interaction Type
CHEMBL2381766 F168 45.52x52 ECL2 aromatic (face-to-edge)
CHEMBL2381766 M177 5.38x40 TM5 hydrophobic
CHEMBL2381766 W246 6.48x48 TM6 hydrophobic
CHEMBL2381766 L249 6.51x51 TM6 hydrophobic
CHEMBL2381766 N253 6.55x55 TM6 Van der Waals
CHEMBL2381766 N253 6.55x55 TM6 polar (hydrogen bond)
CHEMBL2381766 L267 7.32x31 TM7 Van der Waals
CHEMBL2381766 L267 7.32x31 TM7 hydrophobic
CHEMBL2381766 M270 7.35x34 TM7 hydrophobic
CHEMBL2381766 M270 7.35x34 TM7 Van der Waals
CHEMBL2381766 I274 7.39x38 TM7 Van der Waals
CHEMBL2381766 I274 7.39x38 TM7 hydrophobic

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Snake plot — Download: PNG | SVG
ICL1 S N L Q ICL1ECL1 F C A ECL1ICL2 P L R Y N G L V ICL2ECL2 W N N C G Q P K E G K N H S Q G C G E G Q V A C L F E D V V ECL2ICL3 Q P L P G ICL3ECL3 P D C S H A ECL3C-term K A A G T S A R V L A A H G S D G E Q V S L R L N G H P P G V W A N G S A P H P E R R P N G Y A L G L V S G G S A Q E S Q G N T G L P D V E L L S H E L K G V C P E P P G L D D P L A Q D G A G V S C-term M P I M G S S V Y I T V E L A I A V L A I L G N V L V C W A V W L N N V T N Y F V V S L A A A D I A V G V L A I P F A I T I S T G A C H G C L F I A C F V L V L T Q S S I F S L L A I A I D R Y I A I R I T G T R A K G I I A I C W V L S F A I G L T P M L G P M N Y M V Y F N F F A C V L V P L L L M L G V Y L R I F L A A R R Q L K Q M E S E R A R S T L Q K E V H A A K S L A I I V G L F A L C W L P L H I I N C F T F F C P L W L M Y L A I V L S H T N S V V N P F I Y A Y R I R E F R K H V L P F F R Q T I I R S R Q Q E
Helix box plot — Download: PNG | SVG V N G L I A L V A I A L E V T I Y V S S 1 V S L A A A D I A V G L V A I P F A I T I 2 A L L S F I S S Q T L V L V F C A I F L 3 A K G I I A I C W V L S F A I G L T P M 4 Y V G L M L L L P V L V C A F F N F Y V M Y 5 A I I V G L F A L C W L P L H I I N C F 6 F P N V V S N T H S L V I A L Y M L W 7

GPCRdb(A)
GPCRdb(A)
A2A receptor
ECL2
45x52 45.52x52 F168
TM5
5x40 5.38x40 M177
TM6
6x48 6.48x48 W246
6x51 6.51x51 L249
6x55 6.55x55 N253
TM7
7x31 7.32x31 L267
7x34 7.35x34 M270
7x38 7.39x38 I274