| Index | Ligand Name | Structure | PDB code | ligand desolvation |
| 1 | e92 | Crystal structure of human monoamine oxidase B (MAO B) in complex with chlorophenyl-chromone-carboxamide | 6fw0 | 99.23 |
| 2 | e98 | Crystal structure of human monoamine oxidase B (MAO B) in complex with fluorophenyl-chromone-carboxamide | 6fwc | 98.96 |
| 3 | c18 | Structure of human MAO B in complex with the selective inhibitor 7-(3- chlorobenzyloxy)-4-(methylamino)methyl-coumarin | 2v61 | 98.9 |
| 4 | rgz | Crystal structure of human monoamine oxidase B (MAO B) in complex with rosiglitazone | 4a7a | 98.68 |
| 5 | p1b | Crystal structure of human monoamine oxidase B (MAO B) in complex with pioglitazone | 4a79 | 98.33 |