B80: N-{3-[(6S)-6-ethyl-1-(4-fluorobenzyl)-4-hydroxy-2-oxo-1,2,5,6-tetrahydropyridin-3-yl]-1,1-dioxido-2H-1,2,4-benzothiadiazin-7-yl}methanesulfonamide
B80 is a Ligand Of Interest in 3IGV 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 |
3IGV_B80_A_579 | 67% | 4% | 0.145 | 0.956 | 3.43 | 2.55 | 9 | 13 | 0 | 0 | 100% | 1 |
3IGV_B80_B_579 | 61% | 3% | 0.152 | 0.943 | 3.59 | 2.65 | 11 | 8 | 0 | 0 | 100% | 1 |