559: 5-[(4S)-6-(4-chlorophenyl)-1,4-dimethyl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-8-yl]pyridin-2-amine
559 is a Ligand Of Interest in 4Z1S 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 |
4Z1S_559_B_201 | 92% | 19% | 0.087 | 0.978 | 1.95 | 1.51 | 7 | 5 | 1 | 0 | 100% | 1 |
4Z1S_559_A_201 | 92% | 16% | 0.078 | 0.968 | 2.03 | 1.66 | 8 | 10 | 0 | 0 | 100% | 1 |