Fig. 2. BiteNet predictions for the monomer and oligomer structure of the P2X3 receptor.

a Monomer structure with the orthosteric ligand and cation ion alongside the BiteNet prediction for this structure. b Monomer structure with the allosteric ligand, cation ion and ethylene glycole alongside the BiteNet prediction for this structure. c, d Agonist-bound and antagonist-bound structures of the P2X3 trimer, respectively. e, f BiteNet predictions for the agonist-bound and antagonist-bound structures of the P2X3 trimer, respectively. Orthosteric and allosteric ligands are shown with red and magenta sticks, respectively. cation ions are shown as dark green spheres and ethylene glycol molecules are shown with violet sticks. BiteNet predictions for these molecules are shown as spheres with the corresponding color.