627: N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4-C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN-1-YL)BENZAMIDE
627 is a Ligand Of Interest in 2J50 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) |
| 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 |
|---|
| 2J50_627_B_1390 | 41% | 13% | 0.232 | 0.949 | 2.32 | 1.64 | 15 | 8 | 3 | 0 | 100% | 1 |
| 2J50_627_A_1390 | 40% | 13% | 0.231 | 0.944 | 2.32 | 1.64 | 15 | 8 | 3 | 0 | 100% | 1 |
| 8SSO_627_A_503 | 85% | 43% | 0.102 | 0.967 | 0.66 | 1.54 | - | 6 | 0 | 0 | 100% | 1 |
| 8SSP_627_A_510 | 68% | 48% | 0.148 | 0.961 | 0.68 | 1.32 | - | 6 | 0 | 0 | 100% | 1 |
| 5I9Z_627_A_1001 | 92% | 22% | 0.071 | 0.961 | 2.15 | 1.09 | 5 | 4 | 0 | 0 | 100% | 1 |
| 4QO9_627_A_404 | 81% | 1% | 0.103 | 0.954 | 6.43 | 1.54 | 17 | 5 | 0 | 0 | 100% | 1 |
| 2V7A_627_B_1504 | 70% | 11% | 0.129 | 0.948 | 2.34 | 1.85 | 5 | 6 | 0 | 0 | 100% | 1 |
