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Table 1 One hit ligand showing significant agonist/antagonist effect

From: Identification of active small-molecule modulators targeting the novel immune checkpoint VISTA

Macromolecule Hit ligand Hydrogen bonds Potential hydrophobic interactions Predicted binding energy (kcal/mol)
Murine VISTA 6809-0223 NA PHE33, LYS62, LEU150, LYS151, ASN152 − 9.4