09Q: 1-(5-phenylpyridin-3-yl)-1,4-diazepane
09Q is a Ligand Of Interest in 3U8L 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 |
|---|
| 3U8L_09Q_E_211 | 81% | 39% | 0.126 | 0.979 | 1.16 | 1.27 | - | 2 | 1 | 0 | 100% | 1 |
| 3U8L_09Q_I_211 | 77% | 28% | 0.121 | 0.96 | 1.21 | 1.8 | 1 | 3 | 4 | 0 | 100% | 1 |
| 3U8L_09Q_D_211 | 76% | 37% | 0.136 | 0.972 | 1.16 | 1.4 | 1 | 2 | 2 | 0 | 100% | 1 |
| 3U8L_09Q_B_211 | 74% | 42% | 0.136 | 0.966 | 1.08 | 1.2 | - | 1 | 3 | 0 | 100% | 1 |
| 3U8L_09Q_G_211 | 72% | 35% | 0.131 | 0.957 | 1.19 | 1.46 | - | 2 | 2 | 0 | 100% | 1 |
| 3U8L_09Q_J_211 | 71% | 36% | 0.14 | 0.962 | 1.13 | 1.48 | - | 2 | 1 | 0 | 100% | 1 |
| 3U8L_09Q_H_211 | 69% | 43% | 0.145 | 0.96 | 1.14 | 1.1 | - | 2 | 2 | 0 | 100% | 1 |
| 3U8L_09Q_C_211 | 68% | 34% | 0.14 | 0.952 | 1.22 | 1.47 | 1 | 2 | 1 | 0 | 100% | 1 |
| 3U8L_09Q_F_211 | 63% | 39% | 0.158 | 0.955 | 1.13 | 1.3 | - | 3 | 3 | 0 | 100% | 1 |
| 3U8L_09Q_H_212 | 58% | 38% | 0.155 | 0.933 | 1.23 | 1.26 | - | 3 | 3 | 0 | 100% | 1 |
| 3U8L_09Q_H_213 | 53% | 36% | 0.164 | 0.927 | 1.24 | 1.35 | 1 | 2 | 3 | 0 | 100% | 1 |
| 3U8L_09Q_B_212 | 48% | 39% | 0.164 | 0.906 | 1.15 | 1.31 | 1 | 2 | 7 | 0 | 100% | 1 |
| 3U8L_09Q_A_211 | 36% | 32% | 0.216 | 0.912 | 1.1 | 1.69 | 1 | 4 | 1 | 0 | 100% | 1 |
| 3U8L_09Q_B_213 | 22% | 39% | 0.227 | 0.843 | 1.12 | 1.32 | - | 2 | 2 | 0 | 100% | 1 |
