4X21 | pdb_00004x21


3WH: N-ethyl-4-{[4-(1H-indol-3-yl)-5-iodopyrimidin-2-yl]amino}piperidine-1-carboxamide

3WH is a Ligand Of Interest in 4X21 designated by the RCSB


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4X21_3WH_A_501Click 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
4X21_3WH_A_501 91% 34% 0.084 0.9721.05 1.54 1 680100%0.99
4X21_3WH_B_501 88% 36% 0.093 0.9671.29 1.21 2 280100%0.99