Binding information for 1fbm_ligand_3_16.mol2(FDBF00115)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1fbm_ligand_3_16.mol2 | 1fbm | 1 | -6.44 | C(C)(C)CC | 5 |
Structure and binding mode of 1fbm_ligand_3_16.mol2(FDBF00115)
Important binding residues for 1fbm_ligand_3_16.mol2(FDBF00115)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1fbm | VAL47 | -0.58 | 0.00 | -0.58 | 0.03 | -0.54 |
| 1fbm | LEU51 | -0.84 | 0.03 | -0.81 | 0.09 | -0.72 |
| 1fbm | VAL47 | -0.55 | -0.00 | -0.55 | -0.01 | -0.57 |
