Ligand validation:5DCC


PGE: TRIETHYLENE GLYCOL



Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5DCC_PGE_B_514Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5DCC_PGE_B_514Click to see a 3Delectron density viewof this ligand instance
Created with Raphaël 2.3.0WorseGeometryBetterWorseExperiment Data FittingBetter5DCC_PGE_B_514Click 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
5DCC_PGE_B_514 9% 90% 0.331 0.830.32 0.28 - -20100%1
5DCC_PGE_B_512 4% 90% 0.301 0.6940.31 0.3 - -00100%1
5DCC_PGE_A_510 4% 89% 0.326 0.7170.32 0.33 - -10100%1
5DCC_PGE_A_512 4% 88% 0.33 0.7120.35 0.33 - -10100%1
5DCC_PGE_B_513 4% 92% 0.319 0.6890.33 0.22 - -00100%1
5DCC_PGE_A_513 2% 93% 0.357 0.6390.32 0.18 - -40100%1
5DCC_PGE_A_511 0% 90% 0.408 0.312 0.31 0.31 - -00100%1
5DC2_PGE_B_514 6% 86% 0.277 0.710.52 0.2 - -10100%1
4QGP_PGE_B_203 99% 76% 0.05 0.9820.49 0.47 - -00100%1
5CWL_PGE_A_201 93% 89% 0.066 0.9590.28 0.35 - -00100%1
4XWL_PGE_A_707 92% 70% 0.084 0.9730.53 0.61 - -00100%1
5M3Z_PGE_A_403 91% 36% 0.07 0.9571.31 1.23 1 100100%1
1LRL_PGE_A_530 85% 50% 0.085 0.9510.33 1.57 - 270100%1