B5E: 2-(1~{H}-benzimidazol-2-yl)-~{N}-[[4-(2-ethylphenyl)-3-(trifluoromethyl)phenyl]methyl]ethanamine
B5E is a Ligand Of Interest in 6EHU designated by the Author
| 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 |
6EHU_B5E_A_402 | 73% | 71% | 0.117 | 0.945 | 0.55 | 0.56 | - | - | 0 | 0 | 100% | 1 |
6EHU_B5E_B_403 | 70% | 72% | 0.13 | 0.948 | 0.56 | 0.49 | - | - | 0 | 0 | 100% | 1 |
6EHU_B5E_A_403 | 66% | 73% | 0.146 | 0.952 | 0.56 | 0.46 | - | - | 0 | 0 | 100% | 1 |
6EHU_B5E_A_401 | 65% | 72% | 0.13 | 0.934 | 0.54 | 0.51 | - | - | 0 | 0 | 100% | 1 |
6EHU_B5E_B_401 | 51% | 88% | 0.123 | 0.948 | 0.26 | 0.4 | - | - | 0 | 0 | 61% | 0.6129 |
6EHU_B5E_B_402 | 32% | 70% | 0.196 | 0.869 | 0.55 | 0.59 | - | 1 | 3 | 0 | 100% | 1 |