A1CRK: {(2S,3aS,7aS)-1-[(1R,2R)-2-phenylcyclopropane-1-carbonyl]octahydro-1H-indol-2-yl}(1,3-thiazolidin-3-yl)methanone
A1CRK is a Ligand Of Interest in 9XYL 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 |
|---|
| 9XYL_A1CRK_E_801 | 100% | 41% | 0.026 | 0.993 | 0.9 | 1.4 | 1 | 6 | 2 | 0 | 100% | 1 |
| 9XYL_A1CRK_A_801 | 100% | 53% | 0.028 | 0.992 | 0.77 | 1.04 | - | 2 | 0 | 0 | 100% | 1 |
| 9XYL_A1CRK_F_801 | 100% | 36% | 0.027 | 0.991 | 1.23 | 1.29 | 2 | 4 | 0 | 0 | 100% | 1 |
| 9XYL_A1CRK_B_801 | 100% | 44% | 0.03 | 0.992 | 0.87 | 1.27 | 1 | 8 | 0 | 0 | 100% | 1 |
| 9XYL_A1CRK_C_802 | 100% | 25% | 0.033 | 0.988 | 1.22 | 1.84 | 4 | 7 | 1 | 0 | 100% | 1 |
| 9XYL_A1CRK_D_801 | 100% | 38% | 0.036 | 0.988 | 0.9 | 1.5 | 1 | 7 | 0 | 0 | 100% | 1 |
