8QQ: 3-[4-(aminomethyl)phenyl]-2-methyl-6-[[4-oxidanyl-1-[(3~{R})-4,4,4-tris(fluoranyl)-3-phenyl-butanoyl]piperidin-4-yl]methyl]pyrazolo[4,3-d]pyrimidin-7-one
8QQ is a Ligand Of Interest in 5N9T 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 |
5N9T_8QQ_B_1003 | 90% | 14% | 0.071 | 0.953 | 1.89 | 2.13 | 6 | 9 | 0 | 0 | 100% | 1 |
5N9T_8QQ_A_1005 | 87% | 16% | 0.077 | 0.948 | 1.73 | 2.13 | 5 | 9 | 0 | 0 | 100% | 1 |