3NBW | pdb_00003nbw


TR4: 5-amino-3-(methylsulfanyl)-1-phenyl-1H-pyrazole-4-carbonitrile

TR4 is a Ligand Of Interest in 3NBW designated by the RCSB


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter3NBW_TR4_B_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
3NBW_TR4_B_301 62% 4% 0.139 0.9311.88 3.61 3 440100%1
3NBW_TR4_A_301 55% 3% 0.174 0.9421.81 4.03 3 400100%1