Binding information for 4hod_ligand_1_1.mol2(FDBF00012)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4hod_ligand_1_1.mol2 | 4hod | 1 | -6.48 | CC(C)C | 4 |
Structure and binding mode of 4hod_ligand_1_1.mol2(FDBF00012)
Important binding residues for 4hod_ligand_1_1.mol2(FDBF00012)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4hod | PHE253 | -1.30 | -0.02 | -1.32 | 0.96 | -0.36 |
| 4hod | ILE359 | -0.32 | 0.01 | -0.31 | -0.05 | -0.36 |
