A1H67: (3R)-4-[4-(2-chlorophenyl)sulfonyl-1,3-thiazol-5-yl]-1,3-dimethyl-piperazin-2-one
A1H67 is a Ligand Of Interest in 9ETX designated by the Author
| 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 |
9ETX_A1H67_A_301 | 93% | 54% | 0.071 | 0.965 | 0.82 | 0.95 | 1 | 1 | 2 | 0 | 100% | 1 |
9ETX_A1H67_B_301 | 55% | 63% | 0.107 | 0.873 | 0.57 | 0.84 | - | 1 | 0 | 0 | 100% | 1 |