86X: 6-chloranyl-7-fluoranyl-3-[3-[(2R)-3-oxidanylidenepiperidin-2-yl]propyl]quinazolin-4-one
86X is a Ligand Of Interest in 5XII 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 |
5XII_86X_D_1004 | 58% | 15% | 0.146 | 0.923 | 1.29 | 2.43 | 2 | 4 | 0 | 0 | 100% | 0.5 |
5XII_86X_B_1004 | 56% | 15% | 0.156 | 0.928 | 1.29 | 2.43 | 2 | 4 | 1 | 0 | 100% | 0.5 |
5XII_86X_A_1004 | 49% | 15% | 0.147 | 0.895 | 1.33 | 2.42 | 2 | 4 | 1 | 0 | 100% | 0.5 |
5XII_86X_C_1004 | 48% | 15% | 0.169 | 0.911 | 1.32 | 2.43 | 2 | 4 | 1 | 0 | 100% | 0.5 |