Binding information for 1dy4_ligand_1_2.mol2(FDBF00041)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1dy4_ligand_1_2.mol2 | 1dy4 | 1 | -5.61 | CCO | 3 |
Structure and binding mode of 1dy4_ligand_1_2.mol2(FDBF00041)
Important binding residues for 1dy4_ligand_1_2.mol2(FDBF00041)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1dy4 | GLN175 | 0.35 | -3.99 | -3.64 | 0.09 | -3.55 |
| 1dy4 | TRP376 | -0.46 | -0.00 | -0.46 | 0.15 | -0.32 |
