XXB: 1-butyl-1H-pyrazole-5-carboxylic acid
XXB is a Ligand Of Interest in 3TOD designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| 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 |
|---|
| 3TOD_XXB_A_777 | 1% | 20% | 0.292 | 0.488 | 0.45 | 2.88 | - | 4 | 0 | 0 | 100% | 0.7 |
