Binding information for 4zb6_ligand_5_5422.mol2(FDBF00135)
FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
---|---|---|---|---|---|
4zb6_ligand_5_5422.mol2 | 4zb6 | 0.555556 | -5.57 | CCSSCC | 6 |
Structure and binding mode of 4zb6_ligand_5_5422.mol2(FDBF00135)
Important binding residues for 4zb6_ligand_5_5422.mol2(FDBF00135)
PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
---|---|---|---|---|---|---|
4zb6 | PRO17 | -0.55 | -0.18 | -0.73 | 0.25 | -0.48 |