T9S: ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate
T9S is a Ligand Of Interest in 5QY4 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 |
5QY4_T9S_A_2101 | 29% | 9% | 0.169 | 0.828 | 1.7 | 2.73 | 1 | 8 | 0 | 0 | 100% | 17 |
5QY4_T9S_B_401 | 2% | 13% | 0.389 | 0.691 | 1.66 | 2.31 | 1 | 5 | 1 | 0 | 100% | 14.000000000000002 |
8OGS_T9S_A_301 | 22% | 6% | 0.204 | 0.818 | 2.21 | 2.79 | 6 | 9 | 0 | 0 | 100% | 0.29 |