D3J: (2R)-5-[(2-chlorophenyl)sulfanyl]-6'-(4-fluorophenoxy)-4-hydroxy-2-(thiophen-3-yl)-2,3-dihydro[2,2'-bipyridin]-6(1H)-one
D3J is a Ligand Of Interest in 6BB1 designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| 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 |
|---|
| 6BB1_D3J_D_804 | 85% | 22% | 0.091 | 0.957 | 1.3 | 2.06 | 2 | 8 | 0 | 0 | 100% | 1 |
| 6BB1_D3J_G_803 | 81% | 21% | 0.103 | 0.954 | 1.33 | 2.13 | 2 | 8 | 0 | 0 | 100% | 1 |
| 6BB1_D3J_A_803 | 74% | 19% | 0.106 | 0.936 | 1.4 | 2.22 | 3 | 8 | 0 | 0 | 100% | 1 |
| 6BB1_D3J_B_803 | 66% | 25% | 0.14 | 0.945 | 1.27 | 1.94 | 2 | 6 | 0 | 0 | 100% | 1 |
| 6BB1_D3J_E_802 | 60% | 22% | 0.136 | 0.922 | 1.27 | 2.12 | 2 | 7 | 0 | 0 | 100% | 1 |
| 6BB1_D3J_F_803 | 42% | 20% | 0.179 | 0.899 | 1.3 | 2.2 | 2 | 7 | 0 | 0 | 100% | 1 |
