A1JCP: (2~{Z})-2-cyano-2-[3-ethyl-5-[(~{E})-[2-[methyl-(1-methylpiperidin-4-yl)amino]pyridin-4-yl]iminomethyl]-4-oxidanylidene-1,3-thiazol-2-ylidene]-~{N}-[2,2,2-tris(fluoranyl)ethyl]ethanamide
A1JCP is a Ligand Of Interest in 9R1W 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 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 |
|---|
| 9R1W_A1JCP_AAA_401 | 65% | 20% | 0.118 | 0.92 | 1.91 | 1.45 | 8 | 6 | 4 | 0 | 100% | 1 |
| 9R1W_A1JCP_BBB_401 | 33% | 15% | 0.147 | 0.823 | 2.13 | 1.63 | 8 | 8 | 4 | 0 | 100% | 1 |
| 9R8B_A1JCP_A_1001 | 80% | 7% | 0.102 | 0.95 | 2.62 | 2.27 | 11 | 13 | 4 | 0 | 100% | 1 |
