Binding information for 4zb8_ligand_3_520.mol2(FDBF00093)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4zb8_ligand_3_520.mol2 | 4zb8 | 1 | -5.29 | CSSC | 4 |
Structure and binding mode of 4zb8_ligand_3_520.mol2(FDBF00093)
Important binding residues for 4zb8_ligand_3_520.mol2(FDBF00093)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4zb8 | GLY15 | -0.53 | -0.92 | -1.45 | 0.81 | -0.63 |
| 4zb8 | PRO16 | -0.63 | -0.12 | -0.75 | 0.26 | -0.49 |
| 4zb8 | ILE58 | -0.69 | -0.20 | -0.89 | 0.51 | -0.38 |
