Ligand validation:8DT4


3VI: 1,1'-methylenebis{4-[(E)-(hydroxyimino)methyl]pyridin-1-ium}

3VI is a Ligand Of Interest in 8DT4 designated by the Author


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter8DT4_3VI_B_602Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter8DT4_3VI_B_602Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0
Best-fitted instance in this entry
Created with Raphaël 2.3.0
Other instances in this entry
Created with Raphaël 2.3.0
Best-fitted instance in this entry
Created with Raphaël 2.3.0
Best-fitted PDB instances with same target (top 5)
IdentifierRanking for goodness of fit Ranking for geometry Real space R factor Real space correlation coefficient RMSZ-bond-length RMSZ-bond-angleOutliers of bond length Outliers of bond angle Atomic clashesStereochemical errorsModel completenessAverage occupancy
8DT4_3VI_B_602 12% 20% 0.334 0.8662.13 1.28 9 400100%1
8DT4_3VI_A_602 8% 19% 0.387 0.8732.16 1.35 10 500100%1
7RB7_3VI_B_602 15% 21% 0.302 0.8692.15 1.17 10 400100%1
8DT7_3VI_A_601 8% 11% 0.328 0.7952.22 1.96 10 700100%1