Binding information for 3mo5_ligand_3_577.mol2(FDBF00018)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 3mo5_ligand_3_577.mol2 | 3mo5 | 1 | -5.72 | CCCO | 4 |
Structure and binding mode of 3mo5_ligand_3_577.mol2(FDBF00018)
Important binding residues for 3mo5_ligand_3_577.mol2(FDBF00018)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 3mo5 | PHE1144 | -0.86 | -0.04 | -0.9 | 0.27 | -0.62 |
| 3mo5 | ARG1214 | -0.44 | -1.23 | -1.67 | 0.49 | -1.19 |
