A1I3E: 3,4-dihydroisochromen-1-one
A1I3E is a Ligand Of Interest in 9IDW 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 |
| 9IDW_A1I3E_A_403 | 11% | 7% | 0.209 | 0.721 | 2.8 | 1.96 | 6 | 4 | 0 | 0 | 100% | 0.5 |
| 9IDW_A1I3E_B_404 | 3% | 10% | 0.208 | 0.555 | 2.61 | 1.72 | 3 | 3 | 0 | 0 | 100% | 0.8 |
| 9IDW_A1I3E_A_402 | 0% | 5% | 0.246 | 0.228 | 2.81 | 2.43 | 3 | 3 | 1 | 0 | 100% | 0.5 |
| 9IDW_A1I3E_B_403 | 0% | 7% | 0.262 | 0.104 | 2.79 | 2.08 | 4 | 4 | 0 | 0 | 100% | 0.5 |