Binding information for 1fm9_ligand_frag_6.mol2(FDBF00005)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1fm9_ligand_frag_6.mol2 | 1fm9 | 1 | -6.83 | c1ccccc1 | 6 |
Structure and binding mode of 1fm9_ligand_frag_6.mol2(FDBF00005)
Important binding residues for 1fm9_ligand_frag_6.mol2(FDBF00005)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1fm9 | ILE281 | -0.73 | -0.11 | -0.84 | -0.12 | -0.97 |
| 1fm9 | PHE282 | -1.18 | -0.21 | -1.39 | 0.28 | -1.11 |
| 1fm9 | CYS285 | -0.47 | -0.33 | -0.8 | 0.36 | -0.43 |
| 1fm9 | PHE363 | -1.90 | 0.30 | -1.6 | 0.17 | -1.43 |
