EDO: 1,2-ETHANEDIOL



Best-fitted instance in this entry
Other instances in this entry
Best-fitted instance in this entry
Best-fitted PDB instances with same target (top 5)
Best-fitted instance in this entry
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
3INL_EDO_B_704 99% 86% 0.046 0.9850.39 0.33 - -00100%1
3INL_EDO_H_701 98% 84% 0.054 0.9780.37 0.4 - -00100%1
3INL_EDO_G_702 96% 84% 0.063 0.9740.4 0.37 - -00100%1
3INL_EDO_G_705 95% 84% 0.07 0.9750.41 0.35 - -00100%1
3INL_EDO_C_703 94% 87% 0.073 0.970.38 0.31 - -20100%1
3INL_EDO_A_704 93% 78% 0.09 0.9840.38 0.52 - -00100%1
3INL_EDO_F_703 91% 85% 0.072 0.960.39 0.35 - -00100%1
3INL_EDO_G_704 91% 87% 0.085 0.9730.42 0.27 - -00100%1
3INL_EDO_B_701 91% 88% 0.078 0.9640.44 0.23 - -00100%1
3INL_EDO_F_701 90% 76% 0.091 0.9750.38 0.56 - -00100%1
3INL_EDO_B_702 88% 85% 0.072 0.9460.41 0.34 - -00100%1
3INL_EDO_A_701 87% 84% 0.098 0.970.42 0.34 - -00100%1
3INL_EDO_F_501 86% 91% 0.089 0.9590.41 0.16 - -00100%1
3INL_EDO_A_702 86% 89% 0.084 0.9510.43 0.21 - -00100%1
3INL_EDO_D_701 86% 85% 0.087 0.9540.42 0.33 - -00100%1
3INL_EDO_E_501 83% 84% 0.098 0.9560.41 0.35 - -00100%1
3INL_EDO_B_703 82% 88% 0.114 0.9690.38 0.3 - -10100%1
3INL_EDO_C_701 81% 79% 0.101 0.9520.4 0.46 - -10100%1
3INL_EDO_A_705 81% 88% 0.107 0.9580.4 0.27 - -10100%1
3INL_EDO_G_501 80% 74% 0.116 0.9660.35 0.64 - -00100%1
3INL_EDO_C_702 80% 79% 0.092 0.9410.36 0.51 - -00100%1
3INL_EDO_E_701 78% 87% 0.103 0.9460.38 0.32 - -00100%1
3INL_EDO_H_704 77% 90% 0.089 0.9290.4 0.2 - -00100%1
3INL_EDO_E_703 77% 90% 0.109 0.9480.42 0.21 - -00100%1
3INL_EDO_A_703 75% 85% 0.105 0.9390.35 0.4 - -00100%1
3INL_EDO_G_701 73% 79% 0.128 0.9540.36 0.51 - -00100%1
3INL_EDO_H_703 71% 85% 0.108 0.9280.4 0.34 - -10100%1
3INL_EDO_D_702 64% 85% 0.139 0.9390.37 0.38 - -00100%1
3INL_EDO_A_706 61% 77% 0.111 0.8990.35 0.55 - -00100%1
3INL_EDO_E_704 54% 81% 0.136 0.8990.36 0.46 - -00100%1
3INL_EDO_E_702 32% 87% 0.193 0.8640.38 0.32 - -10100%1
3INJ_EDO_B_501 100% 81% 0.033 0.9880.36 0.46 - -00100%1
4KWF_EDO_H_603 99% 82% 0.046 0.9840.33 0.47 - -00100%1
1O04_EDO_F_6916 99% 83% 0.048 0.9820.44 0.34 - -00100%1
3N80_EDO_A_901 97% 77% 0.061 0.9770.45 0.46 - -00100%1
3SZ9_EDO_E_6901 97% 88% 0.059 0.9720.4 0.27 - -00100%1
2G8S_EDO_A_3016 100% 84% 0.02 0.9920.42 0.35 - -00100%0.7
3DPJ_EDO_B_195 100% 82% 0.022 0.9940.47 0.34 - -10100%1
4EYG_EDO_A_402 100% 81% 0.024 0.9950.44 0.39 - -00100%1
4NMU_EDO_D_206 100% 92% 0.025 0.9970.38 0.14 - -00100%1
4Q6J_EDO_A_302 100% 82% 0.013 0.9990.37 0.42 - -00100%1