Table 3 Protein-ligand docking results from HEX server, docked energies obtained from protein-ligand docking of Mala s1 allergen of Malassezia spp. with Calceolarioside A
Receptor protein | Ligand | Cluster | Solution | Etotal |
|---|---|---|---|---|
Mala s1 | Cal A | 1 | 1 | −354.9 |
|  |  | 2 | 1 | −263.3 |
|  |  | 3 | 1 | −252.5 |
|  |  | 4 | 1 | −245.0 |
|  |  | 5 | 1 | −240.1 |
|  |  | 6 | 1 | −236.1 |
|  |  | 7 | 1 | −232.5 |
|  |  | 8 | 1 | −229.5 |
|  |  | 9 | 1 | −227.0 |
|  |  | 10 | 1 | −224.7 |