9FE: 3-bromanyl-1~{H}-indazole-5-carboxylic acid
9FE is a Ligand Of Interest in 5O0B 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 |
5O0B_9FE_B_201 | 57% | 32% | 0.16 | 0.937 | 1.47 | 1.23 | 1 | - | 0 | 0 | 100% | 1 |
5O0B_9FE_A_201 | 41% | 30% | 0.206 | 0.922 | 1.47 | 1.33 | 1 | 1 | 0 | 0 | 100% | 1 |
5O0B_9FE_B_202 | 38% | 34% | 0.199 | 0.903 | 1.43 | 1.2 | 1 | - | 0 | 0 | 100% | 1 |
5O0B_9FE_C_201 | 37% | 33% | 0.201 | 0.898 | 1.48 | 1.16 | 1 | - | 0 | 0 | 100% | 1 |
5O0B_9FE_C_202 | 34% | 37% | 0.255 | 0.941 | 1.57 | 0.92 | 2 | - | 2 | 0 | 100% | 1 |
5O0B_9FE_A_202 | 17% | 37% | 0.329 | 0.908 | 1.39 | 1.11 | 1 | - | 0 | 0 | 100% | 1 |