JGP: (azepan-1-yl)(2H-1,3-benzodioxol-5-yl)methanone
JGP is a Ligand Of Interest in 5SOH designated by the Author
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with different 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 |
|---|
| 5SOH_JGP_A_501 | 72% | 41% | 0.109 | 0.931 | 1.03 | 1.25 | 1 | 3 | 0 | 0 | 100% | 0.66 |
| 5QOL_JGP_A_306 | 15% | 59% | 0.219 | 0.782 | 0.62 | 0.93 | - | 1 | 0 | 0 | 100% | 0.54 |
| 5QDZ_JGP_A_401 | 1% | 5% | 0.328 | 0.559 | 3.2 | 2.07 | 13 | 6 | 0 | 0 | 100% | 0.21 |
