I5I: 2-(5-isothiocyanato-1-benzofuran-2-yl)-4,5-dihydro-1H-imidazole
I5I is a Ligand Of Interest in 3AS3 designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with same target (top 5) |
| 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 |
|---|
| 3AS3_I5I_A_607 | 14% | 0% | 0.262 | 0.81 | 1.86 | 8.54 | 3 | 2 | 0 | 0 | 100% | 1 |
| 3AS3_I5I_A_606 | 10% | 0% | 0.297 | 0.797 | 2.15 | 7.93 | 3 | 2 | 0 | 0 | 100% | 1 |
| 3ARY_I5I_A_606 | 45% | 0% | 0.134 | 0.863 | 1.94 | 8.45 | 4 | 4 | 3 | 0 | 100% | 1 |
| 3ARZ_I5I_A_606 | 10% | 0% | 0.245 | 0.75 | 1.91 | 7.48 | 3 | 3 | 0 | 0 | 100% | 1 |
