Binding information for 3f3d_ligand_1_2.mol2(FDBF00052)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 3f3d_ligand_1_2.mol2 | 3f3d | 1 | -5.53 | CSC | 3 |
Structure and binding mode of 3f3d_ligand_1_2.mol2(FDBF00052)
Important binding residues for 3f3d_ligand_1_2.mol2(FDBF00052)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 3f3d | PHE259 | -0.85 | -0.51 | -1.36 | 0.91 | -0.45 |
| 3f3d | SER355 | -0.74 | -0.22 | -0.96 | 0.50 | -0.46 |
| 3f3d | ILE359 | -0.64 | -0.19 | -0.83 | 0.09 | -0.74 |
