SO4: SULFATE ION
| 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 |
4CGG_SO4_B_1210 | 86% | 94% | 0.105 | 0.973 | 0.25 | 0.19 | - | - | 0 | 0 | 100% | 0.8 |
4CGG_SO4_B_1211 | 83% | 94% | 0.091 | 0.948 | 0.33 | 0.13 | - | - | 0 | 0 | 100% | 0.8 |
4CGG_SO4_A_1210 | 80% | 92% | 0.113 | 0.963 | 0.27 | 0.25 | - | - | 0 | 0 | 100% | 0.8 |
4CGG_SO4_A_1213 | 74% | 94% | 0.097 | 0.927 | 0.32 | 0.11 | - | - | 0 | 0 | 100% | 0.7 |
4CGG_SO4_A_1211 | 73% | 96% | 0.117 | 0.945 | 0.28 | 0.09 | - | - | 0 | 0 | 100% | 0.7 |
4CGG_SO4_B_1213 | 69% | 95% | 0.11 | 0.923 | 0.32 | 0.07 | - | - | 0 | 0 | 100% | 0.7 |
4CGG_SO4_B_1212 | 38% | 94% | 0.155 | 0.856 | 0.33 | 0.12 | - | - | 2 | 0 | 100% | 0.5 |
4CGG_SO4_A_1212 | 34% | 93% | 0.159 | 0.843 | 0.34 | 0.16 | - | - | 2 | 0 | 100% | 0.5 |