2PE: NONAETHYLENE GLYCOL
| 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) |
| 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 |
4D5G_2PE_B_1593 | 20% | 72% | 0.196 | 0.837 | 0.56 | 0.53 | - | - | 0 | 0 | 79% | 0.3929 |
4D5G_2PE_B_1592 | 17% | 72% | 0.214 | 0.833 | 0.61 | 0.46 | - | - | 2 | 0 | 75% | 0.75 |
4D5E_2PE_A_1598 | 38% | 45% | 0.125 | 0.909 | 0.75 | 1.34 | - | 1 | 1 | 0 | 54% | 0.5357 |
5V2O_2PE_A_102 | 95% | 52% | 0.076 | 0.979 | 0.79 | 1.06 | - | 1 | 0 | 0 | 100% | 1 |
2WGG_2PE_H_1419 | 72% | 66% | 0.125 | 0.949 | 0.68 | 0.62 | - | - | 5 | 0 | 100% | 1 |
4V1K_2PE_A_1625 | 69% | 70% | 0.108 | 0.928 | 0.51 | 0.66 | - | - | 0 | 0 | 96% | 0.9464 |
3KQX_2PE_H_6 | 66% | 67% | 0.124 | 0.948 | 0.51 | 0.76 | - | - | 1 | 0 | 89% | 0.8929 |
2FTA_2PE_A_501 | 65% | 6% | 0.108 | 0.91 | 1.99 | 3.05 | 3 | 8 | 0 | 0 | 100% | 1 |