I46: 2-fluoro-4-[4-(4-fluorophenyl)-1H-pyrazol-3-yl]pyridine
I46 is a Ligand Of Interest in 3HP5 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 |
|---|
| 3HP5_I46_A_402 | 62% | 44% | 0.156 | 0.948 | 1.12 | 1.03 | - | 2 | 0 | 0 | 100% | 1 |
| 3HP5_I46_A_403 | 11% | 48% | 0.365 | 0.881 | 1.07 | 0.96 | - | 1 | 0 | 0 | 100% | 1 |
| 3K3I_I46_A_353 | 89% | 9% | 0.085 | 0.963 | 1.72 | 2.76 | 2 | 5 | 1 | 0 | 100% | 1 |
| 3HP2_I46_A_402 | 86% | 45% | 0.094 | 0.962 | 1.01 | 1.11 | - | 1 | 1 | 0 | 100% | 1 |
| 2YIS_I46_A_1354 | 71% | 6% | 0.128 | 0.95 | 1.73 | 3.33 | 7 | 8 | 1 | 0 | 100% | 1 |
| 3K3J_I46_A_362 | 64% | 9% | 0.156 | 0.955 | 1.57 | 2.83 | 2 | 5 | 2 | 0 | 100% | 1 |
| 3HL7_I46_A_402 | 47% | 47% | 0.152 | 0.89 | 1.1 | 0.97 | - | 2 | 4 | 0 | 100% | 1 |
