7W3E


EDO: 1,2-ETHANEDIOL

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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
7W3E_EDO_G_103 98% 67% 0.058 0.9790.72 0.56 - -00100%1
7W3E_EDO_F_102 98% 63% 0.069 0.990.89 0.55 - -00100%1
7W3E_EDO_S_102 96% 68% 0.08 0.9890.72 0.52 - -00100%1
7W3E_EDO_E_202 96% 73% 0.074 0.9810.65 0.4 - -00100%1
7W3E_EDO_A_611 95% 82% 0.087 0.9910.29 0.51 - -00100%1
7W3E_EDO_N_609 95% 80% 0.069 0.9720.28 0.55 - -00100%1
7W3E_EDO_S_103 94% 81% 0.068 0.9680.65 0.18 - -00100%1
7W3E_EDO_C_310 93% 71% 0.064 0.9590.9 0.25 - -00100%1
7W3E_EDO_T_103 93% 57% 0.066 0.960.83 0.83 - -00100%1
7W3E_EDO_F_104 92% 64% 0.075 0.9660.76 0.64 - -00100%1
7W3E_EDO_R_201 90% 69% 0.082 0.9660.61 0.6 - -00100%1
7W3E_EDO_O_305 89% 60% 0.082 0.960.79 0.75 - -00100%1
7W3E_EDO_O_307 88% 72% 0.078 0.9540.58 0.51 - -10100%1
7W3E_EDO_N_608 88% 62% 0.097 0.9730.79 0.65 - -00100%1
7W3E_EDO_N_611 88% 60% 0.084 0.9590.65 0.86 - -00100%1
7W3E_EDO_N_615 87% 71% 0.077 0.9480.62 0.5 - -00100%1
7W3E_EDO_F_103 85% 70% 0.081 0.9460.88 0.28 - -00100%1
7W3E_EDO_S_105 84% 52% 0.087 0.9480.98 0.88 - -00100%1
7W3E_EDO_P_313 83% 66% 0.109 0.9660.84 0.48 - -00100%1
7W3E_EDO_E_203 82% 72% 0.084 0.940.48 0.59 - -00100%1
7W3E_EDO_B_307 82% 77% 0.098 0.9530.49 0.42 - -00100%1
7W3E_EDO_N_612 79% 80% 0.085 0.930.49 0.35 - -00100%1
7W3E_EDO_N_613 77% 69% 0.137 0.9780.64 0.54 - -00100%1
7W3E_EDO_A_609 77% 85% 0.139 0.9780.42 0.32 - -00100%1
7W3E_EDO_N_614 76% 68% 0.083 0.9190.79 0.44 - -00100%1
7W3E_EDO_D_202 75% 74% 0.11 0.9420.47 0.53 - -10100%1
7W3E_EDO_Q_202 71% 86% 0.139 0.960.6 0.14 - -00100%1
7W3E_EDO_A_616 68% 65% 0.108 0.9180.81 0.55 - -00100%1
7W3E_EDO_A_617 67% 63% 0.117 0.9260.7 0.71 - -10100%1
7W3E_EDO_O_306 66% 75% 0.121 0.9270.81 0.2 - -00100%1
7W3E_EDO_N_610 64% 63% 0.127 0.9250.34 1.04 - -00100%1
7W3E_EDO_A_610 63% 45% 0.103 0.8971.08 1.03 - -00100%1
7W3E_EDO_T_104 61% 80% 0.158 0.9480.56 0.28 - -00100%1
7W3E_EDO_A_615 60% 73% 0.183 0.970.35 0.67 - -10100%1
7W3E_EDO_P_314 57% 54% 0.149 0.9240.39 1.36 - -00100%1
7W3E_EDO_A_613 57% 73% 0.122 0.8960.78 0.28 - -00100%1
7W3E_EDO_A_612 54% 62% 0.193 0.960.33 1.09 - -00100%1
7W3E_EDO_B_304 51% 70% 0.197 0.9530.71 0.47 - -00100%1
7W3E_EDO_G_104 49% 68% 0.144 0.8910.63 0.6 - -00100%1
7W3E_EDO_B_306 49% 67% 0.141 0.8860.79 0.51 - -00100%1
7W3E_EDO_A_614 48% 66% 0.136 0.8790.73 0.57 - -00100%1
7W3E_EDO_O_308 46% 71% 0.174 0.9080.56 0.56 - -00100%1
7W3E_EDO_Y_102 43% 92% 0.204 0.9270.48 0.06 - -00100%1
7W3E_EDO_B_308 36% 49% 0.178 0.871.24 0.73 - -00100%1
7W3E_EDO_B_305 35% 38% 0.255 0.9460.91 1.48 - 150100%1
7W3E_EDO_S_104 34% 57% 0.152 0.8350.65 0.98 - -00100%1
7W3E_EDO_S_108 27% 68% 0.109 0.7520.68 0.57 - -30100%1
7W3E_EDO_S_106 20% 69% 0.353 0.9590.68 0.52 - -00100%1
7W3E_EDO_U_101 18% 74% 0.34 0.9270.65 0.38 - -30100%1
7W3E_EDO_S_107 4% 65% 0.28 0.6690.66 0.68 - -00100%1
7YPY_EDO_S_106 100% 84% 0.044 0.9850.7 0.08 - -00100%1
5ZCQ_EDO_E_203 98% 62% 0.057 0.9830.5 0.93 - -00100%1
7VVR_EDO_F_102 98% 56% 0.063 0.9891.04 0.66 - -00100%1
5ZCP_EDO_S_102 97% 61% 0.072 0.9871.07 0.43 - -00100%1
7CP5_EDO_S_103 97% 88% 0.071 0.9850.63 0.06 - -00100%1
6ANS_EDO_A_404 100% 89% 0.029 0.9950.57 0.07 - -00100%1
4FQI_EDO_A_401 100% 85% 0.032 0.9920.46 0.29 - -00100%1
4KXW_EDO_A_1003 100% 73% 0.033 0.9930.64 0.4 - -00100%1
8JK3_EDO_A_304 100% 81% 0.033 0.9920.22 0.58 - -00100%1
3G7R_EDO_B_961 100% 85% 0.035 0.9880.45 0.3 - -10100%1