Binding information for 1g2m_ligand_1_2.mol2(FDBF03537)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1g2m_ligand_1_2.mol2 | 1g2m | 0.685714 | -6.44 | [nH]1c([n+](c2c1cccc2)C)C | 11 |
Structure and binding mode of 1g2m_ligand_1_2.mol2(FDBF03537)
Important binding residues for 1g2m_ligand_1_2.mol2(FDBF03537)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1g2m | SER195 | -0.42 | -0.51 | -0.93 | 0.48 | -0.44 |
| 1g2m | TRP215 | -2.05 | -0.85 | -2.9 | 1.01 | -1.89 |
