BU1: 1,4-BUTANEDIOL
| 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 |
|---|
| 5D5A_BU1_A_1203 | 33% | 88% | 0.262 | 0.942 | 0.12 | 0.55 | - | - | 3 | 0 | 100% | 0.8 |
| 5D5A_BU1_A_1204 | 18% | 88% | 0.272 | 0.861 | 0.12 | 0.53 | - | - | 0 | 0 | 100% | 1 |
| 7ZD0_BU1_C_503 | 69% | 84% | 0.092 | 0.906 | 0.32 | 0.44 | - | - | 1 | 0 | 100% | 1 |
| 2X2U_BU1_A_1294 | 59% | 42% | 0.173 | 0.958 | 0.83 | 1.44 | - | 1 | 8 | 0 | 100% | 1 |
| 6MBG_BU1_A_2001 | 52% | 80% | 0.113 | 0.87 | 0.33 | 0.51 | - | - | 1 | 0 | 100% | 1 |
| 3LAT_BU1_B_222 | 46% | 89% | 0.202 | 0.938 | 0.31 | 0.33 | - | - | 2 | 0 | 100% | 1 |
| 2XAA_BU1_C_1348 | 44% | 78% | 0.187 | 0.917 | 0.53 | 0.35 | - | - | 0 | 0 | 100% | 1 |
