Binding information for 4hy0_ligand_1_4.mol2(FDBF03175)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4hy0_ligand_1_4.mol2 | 4hy0 | 0.933333 | -5.57 | C1(CCC(F)(F)CC1)C | 9 |
Structure and binding mode of 4hy0_ligand_1_4.mol2(FDBF03175)
Important binding residues for 4hy0_ligand_1_4.mol2(FDBF03175)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4hy0 | THR308 | -1.18 | -0.13 | -1.31 | 0.76 | -0.55 |
