BME: BETA-MERCAPTOETHANOL
| 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 |
4I7M_BME_A_201 | 91% | 83% | 0.094 | 0.98 | 0.42 | 0.36 | - | - | 0 | 0 | 100% | 1 |
4I7M_BME_B_205 | 74% | 34% | 0.127 | 0.957 | 0.71 | 1.86 | - | - | 0 | 0 | 100% | 0.5 |
4I7M_BME_B_204 | 56% | 72% | 0.131 | 0.902 | 0.29 | 0.79 | - | - | 0 | 0 | 100% | 1 |
4I7M_BME_A_205 | 34% | 92% | 0.204 | 0.886 | 0.27 | 0.24 | - | - | 2 | 0 | 100% | 0.5 |