Binding information for 2i5j_ligand_1_0.mol2(FDBF01907)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2i5j_ligand_1_0.mol2 | 2i5j | 0.5 | -5.08 | CNN | 3 |
Structure and binding mode of 2i5j_ligand_1_0.mol2(FDBF01907)
Important binding residues for 2i5j_ligand_1_0.mol2(FDBF01907)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 2i5j | PHE227 | -0.72 | 0.07 | -0.65 | 0.18 | -0.47 |
