Binding information for 1o6q_ligand_3_46.mol2(FDBF05813)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1o6q_ligand_3_46.mol2 | 1o6q | 0.666667 | -5.81 | C/C=C/CO | 5 |
Structure and binding mode of 1o6q_ligand_3_46.mol2(FDBF05813)
Important binding residues for 1o6q_ligand_3_46.mol2(FDBF05813)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1o6q | PHE365 | -1.63 | -0.04 | -1.67 | 0.45 | -1.23 |
