HRE: 4-[(4~{S})-5-(5-chloranyl-2-oxidanylidene-1~{H}-pyridin-3-yl)-2-[2-(dimethylamino)-4-methoxy-pyrimidin-5-yl]-6-oxidanylidene-3-propan-2-yl-4~{H}-pyrrolo[3,4-c]pyrazol-4-yl]benzenecarbonitrile
HRE is a Ligand Of Interest in 6Q9U designated by the RCSB
| 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 |
6Q9U_HRE_A_201 | 72% | 8% | 0.11 | 0.932 | 2.33 | 2.31 | 6 | 9 | 4 | 0 | 100% | 1 |
6Q96_HRE_B_201 | 81% | 8% | 0.092 | 0.942 | 2.45 | 2.17 | 7 | 11 | 0 | 0 | 100% | 1 |