Binding information for 1h07_ligand_3_103.mol2(FDBF02607)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1h07_ligand_3_103.mol2 | 1h07 | 1 | -6.21 | Nc1ccc(OC)cc1 | 9 |
Structure and binding mode of 1h07_ligand_3_103.mol2(FDBF02607)
Important binding residues for 1h07_ligand_3_103.mol2(FDBF02607)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1h07 | ILE10 | -1.94 | -0.20 | -2.14 | 0.29 | -1.85 |
| 1h07 | PHE82 | -0.89 | -0.06 | -0.95 | 0.38 | -0.57 |
| 1h07 | HIS84 | -0.82 | -0.02 | -0.84 | 0.18 | -0.66 |
| 1h07 | GLN85 | -0.88 | -0.66 | -1.54 | 0.51 | -1.03 |
| 1h07 | LEU134 | -0.81 | 0.04 | -0.77 | -0.08 | -0.85 |
