5A5: 2-azanyl-5-[(4-propan-2-ylphenyl)methyl]-1,3-thiazole-4-carboxylic acid
5A5 is a Ligand Of Interest in 8HXI 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 |
8HXI_5A5_B_303 | 67% | 40% | 0.128 | 0.937 | 1.2 | 1.15 | 2 | 2 | 0 | 0 | 100% | 1 |
8HXI_5A5_A_303 | 42% | 41% | 0.194 | 0.913 | 1.17 | 1.13 | 1 | - | 0 | 0 | 100% | 0.44 |