AWJ: (2R)-2-[5-(6-amino-5-{(1R)-1-[2-(1,3-dihydro-2H-1,2,3-triazol-2-yl)-5-fluorophenyl]ethoxy}pyridin-3-yl)-4-methyl-1,3-thiazol-2-yl]propane-1,2-diol
AWJ is a Ligand Of Interest in 4CD0 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) |
| 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 |
4CD0_AWJ_A_1500 | 72% | 28% | 0.131 | 0.954 | 1.61 | 1.27 | 7 | 4 | 0 | 0 | 100% | 1 |
7R7R_AWJ_A_1501 | 85% | 45% | 0.1 | 0.965 | 1.08 | 1.05 | 1 | 2 | 0 | 0 | 100% | 1 |
7Z5X_AWJ_B_2301 | 88% | 67% | 0.092 | 0.968 | 0.4 | 0.86 | - | 1 | 0 | 0 | 100% | 1 |