Ligand validation:5SCF


I91: N-(3-hydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)glycine

I91 is a Ligand Of Interest in 5SCF designated by the Author


Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5SCF_I91_C_603Click 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
5SCF_I91_C_603 57% 94% 0.152 0.9260.15 0.27 - -00100%0.99
5SCF_I91_F_603 51% 92% 0.19 0.9440.22 0.29 - -00100%0.99
5SCF_I91_G_603 47% 85% 0.15 0.8880.21 0.53 - -10100%0.99
5SCF_I91_B_603 26% 43% 0.255 0.8980.17 1.99 - 210100%1