MPD: (4S)-2-METHYL-2,4-PENTANEDIOL



Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UJ2_MPD_A_1352Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UJ2_MPD_A_1352Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter4UJ2_MPD_A_1352Click 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
4UJ2_MPD_A_1352 68% 52% 0.145 0.9581.33 0.54 1 -00100%1
4UJ9_MPD_A_1352 35% 50% 0.137 0.8251.14 0.81 - -30100%1
5N1D_MPD_A_401 30% 53% 0.152 0.8160.53 1.26 - 220100%1
4C37_MPD_A_1352 22% 60% 0.162 0.7750.97 0.58 1 -10100%1
5N1N_MPD_A_401 12% 58% 0.176 0.6990.69 0.92 - 130100%1
1L3R_MPD_E_382 11% 43% 0.275 0.7970.7 1.5 - 200100%1
4QSR_MPD_A_1204 96% 63% 0.078 0.990.55 0.84 - -00100%1
3BUI_MPD_A_1048 95% 60% 0.069 0.9740.57 0.95 - -01100%1
4WPG_MPD_A_301 95% 47% 0.056 0.9580.43 1.57 - 310100%1
3GWZ_MPD_D_353 94% 90% 0.056 0.9530.31 0.29 - -00100%1
6JOW_MPD_B_901 93% 71% 0.066 0.9620.34 0.77 - -30100%1