51S: 2,4-dimethylaniline
| 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 |
5CIB_51S_C_302 | 16% | 55% | 0.273 | 0.845 | 0.58 | 1.14 | - | 1 | 0 | 0 | 100% | 1 |
5CIB_51S_A_302 | 4% | 56% | 0.362 | 0.746 | 0.57 | 1.1 | - | 1 | 1 | 0 | 100% | 1 |