B96: 1-(5-TERT-BUTYL-2-P-TOLYL-2H-PYRAZOL-3-YL)-3-[4-(2-MORPHOLIN-4-YL-ETHOXY)-NAPHTHALEN-1-YL]-UREA
B96 is a Ligand Of Interest in 3NPC 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 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 |
|---|
| 3NPC_B96_A_365 | 74% | 43% | 0.133 | 0.963 | 0.84 | 1.34 | 2 | 7 | 0 | 0 | 100% | 1 |
| 3NPC_B96_B_365 | 66% | 45% | 0.149 | 0.954 | 0.73 | 1.39 | 1 | 6 | 0 | 0 | 100% | 1 |
| 9CJ4_B96_A_401 | 94% | 1% | 0.06 | 0.959 | 5 | 3.37 | 20 | 24 | 0 | 0 | 100% | 1 |
| 3FZS_B96_A_999 | 60% | 27% | 0.111 | 0.896 | 0.89 | 2.02 | - | 8 | 1 | 0 | 100% | 1 |
| 4JVG_B96_C_801 | 51% | 28% | 0.215 | 0.971 | 1.44 | 1.44 | 4 | 7 | 4 | 0 | 100% | 1 |
| 6GTT_B96_A_500 | 46% | 54% | 0.165 | 0.901 | 0.79 | 0.99 | 2 | 6 | 1 | 0 | 100% | 1 |
| 8YGW_B96_A_401 | 29% | 57% | 0.301 | 0.962 | 0.74 | 0.91 | 2 | 3 | 1 | 0 | 100% | 1 |
