Binding information for 1lv8_ligand_3_6.mol2(FDBF00684)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1lv8_ligand_3_6.mol2 | 1lv8 | 1 | -5.78 | CC(OC)C | 5 |
Structure and binding mode of 1lv8_ligand_3_6.mol2(FDBF00684)
Important binding residues for 1lv8_ligand_3_6.mol2(FDBF00684)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1lv8 | PHE200 | -0.43 | 0.06 | -0.37 | 0.03 | -0.34 |
| 1lv8 | MET219 | -1.00 | -0.05 | -1.05 | 0.21 | -0.85 |
| 1lv8 | PHE1159 | -0.63 | -0.13 | -0.76 | 0.36 | -0.40 |
