Binding information for 2oc7_ligand_frag_8.mol2(FDBF01324)
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
2oc7_ligand_frag_8.mol2 | 2oc7 | 1 | -5.97 | C1CCC1 | 4 |
Structure and binding mode of 2oc7_ligand_frag_8.mol2(FDBF01324)
Important binding residues for 2oc7_ligand_frag_8.mol2(FDBF01324)
PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
---|---|---|---|---|---|---|
2oc7 | ILE132 | -0.68 | -0.02 | -0.7 | 0.32 | -0.38 |