Binding information for 1o6r_ligand_1_0.mol2(FDBF00022)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1o6r_ligand_1_0.mol2 | 1o6r | 1 | -5.88 | C(=C)C | 3 |
Structure and binding mode of 1o6r_ligand_1_0.mol2(FDBF00022)
Important binding residues for 1o6r_ligand_1_0.mol2(FDBF00022)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1o6r | TRP312 | -1.04 | 0.06 | -0.98 | 0.66 | -0.32 |
| 1o6r | TRP489 | -0.89 | -0.10 | -0.99 | 0.30 | -0.69 |
