3E8: 3-[1-(3-{5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl}benzyl)-6-oxo-1,6-dihydropyridazin-3-yl]benzonitrile
3E8 is a Ligand Of Interest in 4R1V designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with same target (top 5) |
| 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 |
|---|
| 4R1V_3E8_A_1401 | 91% | 34% | 0.079 | 0.967 | 1.22 | 1.49 | 4 | 8 | 0 | 0 | 100% | 1 |
| 8AW1_3E8_B_1401 | 69% | 41% | 0.119 | 0.934 | 0.78 | 1.56 | 1 | 10 | 0 | 0 | 100% | 1 |
| 8AU3_3E8_B_1401 | 66% | 33% | 0.164 | 0.971 | 0.95 | 1.77 | 2 | 12 | 0 | 0 | 100% | 1 |
| 8AU5_3E8_A_1401 | 43% | 38% | 0.21 | 0.937 | 0.88 | 1.6 | 1 | 11 | 0 | 0 | 100% | 1 |
