Binding information for 4f0c_ligand_4_2076.mol2(FDBF00138)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4f0c_ligand_4_2076.mol2 | 4f0c | 0.642857 | -5.50 | S(SC)CC | 5 |
Structure and binding mode of 4f0c_ligand_4_2076.mol2(FDBF00138)
Important binding residues for 4f0c_ligand_4_2076.mol2(FDBF00138)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4f0c | GLY15 | -0.41 | -1.17 | -1.58 | 0.93 | -0.64 |
| 4f0c | PRO16 | -0.99 | 0.04 | -0.95 | 0.12 | -0.83 |
