Ligand validation:4DDY


DN6: N-[3-(1H-tetrazol-5-yl)phenyl]-3-(trifluoromethyl)benzamide

DN6 is a Ligand Of Interest in 4DDY designated by the RCSB


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4DDY_DN6_A_301Click 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
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
4DDY_DN6_A_301 92% 10% 0.071 0.961.63 2.62 5 900100%1
4DDY_DN6_B_303 88% 21% 0.073 0.9491.36 1.96 4 800100%1
4DDY_DN6_A_302 65% 15% 0.118 0.9181.65 2.1 4 700100%1
4DDY_DN6_B_302 51% 18% 0.116 0.8691.67 1.88 4 600100%1
4DDY_DN6_B_306 48% 17% 0.19 0.9321.66 1.91 4 7120100%1
4DDY_DN6_A_303 30% 20% 0.244 0.9071.77 1.65 5 600100%1
4DDY_DN6_A_304 20% 18% 0.263 0.8691.76 1.74 5 500100%1
4DDY_DN6_B_305 18% 20% 0.238 0.8231.78 1.59 6 500100%1
4DDY_DN6_B_301 17% 19% 0.224 0.8051.81 1.66 5 610100%1
4DDY_DN6_B_304 3% 20% 0.295 0.6231.62 1.75 4 600100%1
4DDY_DN6_B_308 2% 13% 0.314 0.568 1.93 2.02 6 800100%1
4DDY_DN6_B_307 0% 9% 0.483 0.532 1.9 2.5 6 15160100%1