Binding information for 11gs_ligand_4_1329.mol2(FDBF01029)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 11gs_ligand_4_1329.mol2 | 11gs | 0.75 | -5.79 | CSCCCC | 6 |
Structure and binding mode of 11gs_ligand_4_1329.mol2(FDBF01029)
Important binding residues for 11gs_ligand_4_1329.mol2(FDBF01029)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 11gs | ILE104 | -0.32 | 0.03 | -0.29 | -0.07 | -0.36 |
