Ligand validation:5L5X


MES: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID



Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5L5X_MES_H_302Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5L5X_MES_H_302Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5L5X_MES_H_302Click 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 same target (top 5)
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
5L5X_MES_H_302 45% 19% 0.236 0.9682.25 1.25 1 200100%1
5L5X_MES_V_302 38% 17% 0.229 0.9312.22 1.4 1 300100%1
5L5X_MES_X_201 35% 19% 0.245 0.9362.27 1.21 1 200100%0.8
5L5X_MES_K_303 14% 18% 0.32 0.8782.32 1.25 1 200100%0.6
5L52_MES_Y_303 83% 15% 0.117 0.9762.33 1.46 1 210100%0.8
6HWF_MES_Y_302 79% 15% 0.136 0.9822.23 1.59 1 200100%0.75
4QW4_MES_K_303 78% 17% 0.135 0.9782.28 1.38 1 100100%1
4QLQ_MES_K_302 78% 16% 0.121 0.9632.3 1.39 1 100100%1
4QZ7_MES_Y_303 77% 18% 0.133 0.9722.22 1.34 1 200100%1
2IUY_MES_B_1355 100% 9% 0.026 0.9971.73 2.73 1 700100%1
3DPJ_MES_A_192 100% 8% 0.022 0.9952.2 2.41 1 630100%1
5A0C_MES_B_1002 100% 11% 0.033 0.9931.84 2.39 3 300100%1
8AJQ_MES_H_201 100% 38% 0.037 0.9921.52 0.93 1 100100%1
5APG_MES_A_1187 100% 12% 0.044 0.991.48 2.57 3 600100%0.9292