Binding information for 4eft_ligand_1_1.mol2(FDBF06811)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4eft_ligand_1_1.mol2 | 4eft | 0.555556 | -5.42 | CCC#N | 4 |
Structure and binding mode of 4eft_ligand_1_1.mol2(FDBF06811)
Important binding residues for 4eft_ligand_1_1.mol2(FDBF06811)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4eft | LEU107 | -0.66 | 0.09 | -0.57 | -0.22 | -0.80 |
| 4eft | PHE138 | -0.46 | -0.36 | -0.82 | 0.44 | -0.38 |
