XNB: N~8~-(cyclopropylmethyl)-N~4~-[2-(methylsulfanyl)phenyl]-2-(piperazin-1-yl)pyrimido[5,4-d]pyrimidine-4,8-diamine
XNB is a Ligand Of Interest in 3Q92 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 |
3Q92_XNB_A_301 | 55% | 7% | 0.196 | 0.964 | 2.35 | 2.46 | 9 | 11 | 4 | 0 | 100% | 1 |
3Q92_XNB_B_301 | 41% | 4% | 0.236 | 0.952 | 2.37 | 3.14 | 11 | 14 | 1 | 0 | 100% | 1 |