Binding information for 1xa5_ligand_1_4.mol2(FDBF00640)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1xa5_ligand_1_4.mol2 | 1xa5 | 0.571429 | -5.33 | C(Cl)C | 3 |
Structure and binding mode of 1xa5_ligand_1_4.mol2(FDBF00640)
Important binding residues for 1xa5_ligand_1_4.mol2(FDBF00640)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 1xa5 | MET124 | -0.57 | 0.10 | -0.47 | 0.04 | -0.44 |
