Binding information for 2z7g_ligand_1_2.mol2(FDBF00042)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2z7g_ligand_1_2.mol2 | 2z7g | 1 | -5.94 | CC(O)C | 4 |
Structure and binding mode of 2z7g_ligand_1_2.mol2(FDBF00042)
Important binding residues for 2z7g_ligand_1_2.mol2(FDBF00042)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 2z7g | LEU15 | -0.09 | 0.05 | -0.04 | -0.29 | -0.32 |
| 2z7g | ARG98 | -0.28 | -1.67 | -1.95 | 1.30 | -0.65 |
| 2z7g | TYR99 | -0.47 | -0.18 | -0.65 | -0.33 | -0.98 |
| 2z7g | CYS150 | -0.53 | -0.61 | -1.14 | 0.79 | -0.35 |
| 2z7g | ALA180 | -0.34 | -0.07 | -0.41 | 0.10 | -0.31 |
