PDB
7INL
Resolution
2.2 Å
Released
May 20, 2026
Receptor
A2A
Class
A
Species
Homo sapiens
Ligand
Function
5-methyl-1,2-oxazole-3-carbothioamide
Antagonist
Reference
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Ligand Amino Acid Generic Number Segment Interaction Type
5-methyl-1,2-oxazole-3-carbothioamide V84 3.32x32 TM3 hydrophobic
5-methyl-1,2-oxazole-3-carbothioamide L85 3.33x33 TM3 Van der Waals
5-methyl-1,2-oxazole-3-carbothioamide F168 45.52x52 ECL2 hydrophobic
5-methyl-1,2-oxazole-3-carbothioamide F168 45.52x52 ECL2 aromatic (face-to-face)
5-methyl-1,2-oxazole-3-carbothioamide E169 ECL2 polar (hydrogen bond)
5-methyl-1,2-oxazole-3-carbothioamide M177 5.38x40 TM5 Van der Waals
5-methyl-1,2-oxazole-3-carbothioamide L249 6.51x51 TM6 hydrophobic
5-methyl-1,2-oxazole-3-carbothioamide N253 6.55x55 TM6 polar (hydrogen bond)
5-methyl-1,2-oxazole-3-carbothioamide N253 6.55x55 TM6 polar (hydrogen bond)
5-methyl-1,2-oxazole-3-carbothioamide M270 7.35x34 TM7 Van der Waals
5-methyl-1,2-oxazole-3-carbothioamide I274 7.39x38 TM7 Van der Waals

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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
TM3
3x32 3.32x32 V84
3x33 3.33x33 L85
ECL2
45x52 45.52x52 F168
TM5
5x40 5.38x40 M177
TM6
6x51 6.51x51 L249
6x55 6.55x55 N253
TM7
7x34 7.35x34 M270
7x38 7.39x38 I274