Binding information for 3b92_ligand_frag_4.mol2(FDBF00283)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 3b92_ligand_frag_4.mol2 | 3b92 | 1 | -5.13 | O=SO | 3 |
Structure and binding mode of 3b92_ligand_frag_4.mol2(FDBF00283)
Important binding residues for 3b92_ligand_frag_4.mol2(FDBF00283)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 3b92 | THR347 | -0.81 | -1.43 | -2.24 | 0.62 | -1.61 |
| 3b92 | LEU348 | -0.64 | -0.31 | -0.95 | 0.19 | -0.77 |
