A1CKQ: N-[(1R,4r)-4-(5-{(6P)-6-[(8R)-3-cyanopyrrolo[1,2-b]pyridazin-7-yl]-4-[(propan-2-yl)amino]pyridin-3-yl}-1,3,4-thiadiazol-2-yl)cyclohexyl]acetamide
A1CKQ is a Ligand Of Interest in 9PST 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 |
|---|
| 9PST_A1CKQ_D_501 | 84% | 38% | 0.089 | 0.95 | 0.82 | 1.59 | - | 6 | 0 | 0 | 100% | 1 |
| 9PST_A1CKQ_A_501 | 83% | 37% | 0.082 | 0.94 | 0.9 | 1.55 | - | 6 | 0 | 0 | 100% | 1 |
| 9PST_A1CKQ_B_501 | 78% | 41% | 0.1 | 0.941 | 0.86 | 1.4 | - | 5 | 0 | 0 | 100% | 1 |
| 9PST_A1CKQ_C_501 | 74% | 33% | 0.098 | 0.928 | 0.94 | 1.7 | - | 9 | 0 | 0 | 100% | 1 |
