T9Y: ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
T9Y is a Ligand Of Interest in 9HZH designated by the Author
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with different target (top 5) |
| Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
|---|
| 9HZH_T9Y_A_404 | 37% | 13% | 0.157 | 0.852 | 1.79 | 2.15 | 2 | 3 | 0 | 0 | 100% | 1 |
| 9HZH_T9Y_B_404 | 16% | 13% | 0.197 | 0.762 | 1.79 | 2.18 | 2 | 3 | 0 | 0 | 100% | 1 |
| 9RQ7_T9Y_B_201 | 8% | 67% | 0.227 | 0.7 | 0.47 | 0.78 | - | 1 | 0 | 0 | 100% | 0.38 |
| 5QYF_T9Y_B_401 | 7% | 7% | 0.325 | 0.79 | 1.6 | 3.09 | 1 | 6 | 1 | 0 | 100% | 0.32 |
| 7IPT_T9Y_A_201 | 7% | 26% | 0.289 | 0.748 | 1.58 | 1.43 | 1 | 2 | 3 | 0 | 100% | 17 |
