IRU: 1~{H}-pyrazol-5-ylmethanol

IRU is a Ligand Of Interest in 7H8A designated by the Author


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter7H8A_IRU_A_208Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter7H8A_IRU_A_208Click 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
7H8A_IRU_A_208 3% 36% 0.286 0.5960.71 1.78 - 120100%0.55
7H8A_IRU_C_305 1% 56% 0.314 0.446 0.62 1.08 - 100100%0.55
9HSV_IRU_A_801 78% 11% 0.095 0.9381.48 2.67 2 100100%1
7QVN_IRU_A_801 17% 2% 0.329 0.9123.16 3.51 3 100100%1