XRO: 5-{2-[4-(cyanomethyl)phenyl]ethyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
XRO is a Ligand Of Interest in 3W1X 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 |
3W1X_XRO_B_401 | 97% | 8% | 0.064 | 0.979 | 2.02 | 2.84 | 6 | 4 | 2 | 0 | 100% | 1 |
3W1X_XRO_A_401 | 95% | 3% | 0.068 | 0.974 | 2.58 | 3.58 | 6 | 3 | 0 | 0 | 100% | 1 |