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 |