QDT: 2-methylpropyl 1-[8-methoxy-5-(1-oxidanylidene-3~{H}-2-benzofuran-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropane-1-carboxylate
QDT is a Ligand Of Interest in 6ZBA 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 |
6ZBA_QDT_DDD_801 | 54% | 42% | 0.129 | 0.893 | 0.77 | 1.48 | 1 | 4 | 8 | 0 | 100% | 0.85 |
6ZBA_QDT_AAA_801 | 44% | 39% | 0.128 | 0.854 | 0.93 | 1.42 | 2 | 4 | 0 | 0 | 100% | 0.85 |
6ZBA_QDT_CCC_801 | 36% | 44% | 0.136 | 0.829 | 0.72 | 1.44 | 2 | 2 | 2 | 0 | 100% | 0.85 |
6ZBA_QDT_BBB_801 | 30% | 46% | 0.157 | 0.819 | 0.73 | 1.33 | 1 | 3 | 0 | 0 | 100% | 0.85 |