KK3: 4-(4-methylpiperidin-1-yl)-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
KK3 is a Ligand Of Interest in 4QAC designated by the RCSB
| 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 |
|---|
| 4QAC_KK3_C_301 | 80% | 35% | 0.104 | 0.952 | 1.21 | 1.43 | 3 | 2 | 1 | 0 | 100% | 1 |
| 4QAC_KK3_F_304 | 78% | 35% | 0.103 | 0.947 | 1.34 | 1.3 | 6 | 2 | 2 | 0 | 100% | 1 |
| 4QAC_KK3_H_303 | 74% | 32% | 0.115 | 0.944 | 1.34 | 1.49 | 4 | 4 | 3 | 0 | 100% | 1 |
| 4QAC_KK3_E_302 | 72% | 34% | 0.116 | 0.939 | 1.21 | 1.48 | 4 | 3 | 1 | 0 | 100% | 1 |
| 4QAC_KK3_D_304 | 71% | 27% | 0.121 | 0.943 | 1.58 | 1.5 | 7 | 4 | 3 | 0 | 100% | 1 |
| 4QAC_KK3_J_302 | 71% | 31% | 0.118 | 0.939 | 1.44 | 1.42 | 5 | 5 | 2 | 0 | 100% | 1 |
| 4QAC_KK3_G_302 | 66% | 30% | 0.123 | 0.929 | 1.19 | 1.71 | 2 | 5 | 1 | 0 | 100% | 1 |
| 4QAC_KK3_A_304 | 65% | 32% | 0.125 | 0.926 | 1.4 | 1.42 | 4 | 4 | 1 | 0 | 100% | 1 |
| 4QAC_KK3_I_304 | 64% | 32% | 0.129 | 0.929 | 1.18 | 1.63 | 3 | 4 | 2 | 0 | 100% | 1 |
| 4QAC_KK3_B_303 | 64% | 33% | 0.124 | 0.923 | 1.53 | 1.22 | 4 | 3 | 2 | 0 | 100% | 1 |
