Binding information for 4x6s_ligand_frag_6.mol2(FDBF00004)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4x6s_ligand_frag_6.mol2 | 4x6s | 1 | -4.75 | CC(=O)O | 4 |
Structure and binding mode of 4x6s_ligand_frag_6.mol2(FDBF00004)
Important binding residues for 4x6s_ligand_frag_6.mol2(FDBF00004)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 4x6s | ARG462 | -0.31 | -35.29 | -35.6 | 34.33 | -1.27 |
