Binding information for 1lv8_ligand_2_7.mol2(FDBF00826)
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
1lv8_ligand_2_7.mol2 | 1lv8 | 0.666667 | -5.41 | O(CC)C | 4 |
Structure and binding mode of 1lv8_ligand_2_7.mol2(FDBF00826)
Important binding residues for 1lv8_ligand_2_7.mol2(FDBF00826)
PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
---|---|---|---|---|---|---|
1lv8 | MET219 | -0.69 | -0.10 | -0.79 | 0.13 | -0.66 |
1lv8 | PHE1159 | -0.58 | -0.22 | -0.8 | 0.41 | -0.39 |