51I: 2-azanyl-5-[(4-propylphenyl)methyl]-1,3-thiazole-4-carboxylic acid
51I is a Ligand Of Interest in 8HXE 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 |
8HXE_51I_A_303 | 54% | 31% | 0.163 | 0.929 | 1.55 | 1.22 | 2 | 2 | 0 | 0 | 100% | 1 |
8HXE_51I_B_303 | 24% | 32% | 0.247 | 0.879 | 1.63 | 1.08 | 2 | 3 | 0 | 0 | 100% | 1 |