Binding information for 2v10_ligand_4_1371.mol2(FDBF00197)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2v10_ligand_4_1371.mol2 | 2v10 | 0.911765 | -6.69 | C(c1cc(ccc1)O)CC | 10 |
Structure and binding mode of 2v10_ligand_4_1371.mol2(FDBF00197)
Important binding residues for 2v10_ligand_4_1371.mol2(FDBF00197)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 2v10 | GLN19 | -0.36 | 0.13 | -0.23 | -0.21 | -0.45 |
| 2v10 | VAL36 | -0.24 | 0.04 | -0.2 | -0.11 | -0.31 |
| 2v10 | TYR83 | -1.18 | 0.06 | -1.12 | 0.34 | -0.79 |
| 2v10 | PHE119 | -1.05 | -0.12 | -1.17 | 0.31 | -0.86 |
| 2v10 | ALA122 | -0.28 | -0.18 | -0.46 | 0.11 | -0.35 |
| 2v10 | PHE124 | -1.10 | -0.47 | -1.57 | 0.55 | -1.02 |
| 2v10 | VAL127 | -0.34 | 0.04 | -0.3 | -0.16 | -0.46 |
