Ligand validation:6M7I


J84: 1-(2,4-dichlorophenyl)-4-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine

J84 is a Ligand Of Interest in 6M7I designated by the Author


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter6M7I_J84_A_304Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter6M7I_J84_A_304Click 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 different 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
6M7I_J84_A_304 36% 9% 0.176 0.872 2.44 4 600100%0.67
6M7I_J84_A_302 27% 9% 0.192 0.8382.06 2.37 6 600100%0.63
6M7I_J84_A_303 18% 7% 0.182 0.7691.98 2.75 7 600100%0.8
6M7I_J84_A_301 9% 10% 0.213 0.6962 2.25 5 600100%0.72
6MD8_J84_A_601 80% 9% 0.098 0.9461.81 2.59 3 700100%0.79