A1BB1: (3aR,4R,5S,5aR,10bR)-3a-hydroxy-N,8,10-trimethoxy-5a-(4-methoxyphenyl)-N,2-dimethyl-5-phenyl-3a,4,5,5a-tetrahydro-1H-[1]benzofuro[3',2':1,5]cyclopenta[1,2-d]imidazole-4-carboxamide
A1BB1 is a Ligand Of Interest in 9DTS 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 |
|---|
| 9DTS_A1BB1_X_101 | 85% | 54% | 0.081 | 0.947 | 0.93 | 0.87 | 2 | 1 | 0 | 0 | 100% | 1 |
| 9DTS_A1BB1_W_101 | 84% | 49% | 0.083 | 0.946 | 0.84 | 1.12 | 2 | 3 | 0 | 0 | 100% | 1 |
| 9DTS_A1BB1_Y_101 | 83% | 55% | 0.09 | 0.947 | 0.67 | 1.05 | 2 | 3 | 0 | 0 | 100% | 1 |
| 9DTS_A1BB1_D_503 | 69% | 52% | 0.105 | 0.919 | 0.69 | 1.14 | 1 | 3 | 0 | 0 | 100% | 1 |
