Binding information for 2wl0_ligand_1_12.mol2(FDBF00012)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2wl0_ligand_1_12.mol2 | 2wl0 | 1 | -6.43 | CC(C)(C)C | 5 |
Structure and binding mode of 2wl0_ligand_1_12.mol2(FDBF00012)
Important binding residues for 2wl0_ligand_1_12.mol2(FDBF00012)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 2wl0 | ILE147 | -0.80 | 0.01 | -0.79 | -0.00 | -0.79 |
| 2wl0 | VAL184 | -0.42 | 0.00 | -0.42 | 0.02 | -0.39 |
