Binding information for 2hh5_ligand_frag_0.mol2(FDBF00283)
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 2hh5_ligand_frag_0.mol2 | 2hh5 | 1 | -5.11 | OS=O | 3 |
Structure and binding mode of 2hh5_ligand_frag_0.mol2(FDBF00283)
Important binding residues for 2hh5_ligand_frag_0.mol2(FDBF00283)
| PDBID | RESIDUE | ΔEvdw | ΔEele | ΔEgas | ΔEsolv | ΔEgb |
|---|---|---|---|---|---|---|
| 2hh5 | MET71 | -0.43 | -1.01 | -1.44 | 0.54 | -0.89 |
| 2hh5 | GLY137 | -0.29 | -0.93 | -1.22 | 0.46 | -0.76 |
| 2hh5 | VAL162 | -0.69 | -0.47 | -1.16 | -0.39 | -1.55 |
| 2hh5 | ASN163 | -0.30 | -1.86 | -2.16 | 0.62 | -1.54 |
| 2hh5 | HIS164 | -0.78 | 1.06 | 0.28 | -0.74 | -0.46 |
