RE4: 6-methyl-N~4~-[(pyridin-3-yl)methyl]pyrimidine-2,4-diamine
RE4 is a Ligand Of Interest in 5R2C designated by the Author
| 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 |
5R2C_RE4_A_402 | 20% | 83% | 0.174 | 0.772 | 0.41 | 0.38 | - | - | 0 | 0 | 100% | 0.68 |
5R2C_RE4_A_404 | 12% | 70% | 0.183 | 0.705 | 0.62 | 0.52 | - | - | 0 | 0 | 100% | 0.68 |
5R2C_RE4_A_401 | 6% | 55% | 0.243 | 0.675 | 0.89 | 0.84 | 1 | 1 | 1 | 0 | 100% | 0.68 |
5R2C_RE4_A_403 | 2% | 70% | 0.262 | 0.566 | 0.5 | 0.66 | - | - | 0 | 0 | 100% | 0.68 |
8CFW_RE4_B_506 | 13% | 10% | 0.173 | 0.713 | 2.29 | 2.04 | 2 | 6 | 1 | 0 | 100% | 0.74 |