21G: (2S,3S)-3-[[5-fluoranyl-2-(5-fluoranyl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]bicyclo[2.2.2]octane-2-carboxylic acid
21G is a Ligand Of Interest in 4P1U 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 different 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 |
|---|
| 4P1U_21G_A_4000 | 85% | 21% | 0.099 | 0.964 | 1.37 | 2.1 | 4 | 8 | 0 | 0 | 100% | 1 |
| 7AS1_21G_A_501 | 89% | 32% | 0.08 | 0.96 | 1.07 | 1.73 | 2 | 8 | 0 | 0 | 100% | 0.9976 |
| 7AS3_21G_A_502 | 88% | 42% | 0.067 | 0.941 | 0.76 | 1.51 | - | 6 | 0 | 0 | 100% | 0.9969 |
| 7AS2_21G_A_501 | 71% | 27% | 0.089 | 0.908 | 1.47 | 1.63 | 4 | 6 | 0 | 0 | 100% | 1 |
| 6EUV_21G_A_601 | 66% | 25% | 0.159 | 0.966 | 1.18 | 1.99 | 4 | 11 | 0 | 0 | 100% | 1 |
| 5WL0_21G_A_801 | 64% | 19% | 0.159 | 0.959 | 1.61 | 2.02 | 5 | 11 | 0 | 0 | 100% | 1 |
