7D5W


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
7D5W_EDO_G_102 94% 66% 0.071 0.9720.83 0.5 - -00100%1
7D5W_EDO_S_103 92% 87% 0.082 0.9740.59 0.12 - -00100%1
7D5W_EDO_B_303 92% 74% 0.085 0.9770.72 0.3 - -00100%1
7D5W_EDO_S_102 86% 61% 0.115 0.9850.77 0.72 - -00100%1
7D5W_EDO_N_615 86% 79% 0.086 0.9550.54 0.34 - -00100%1
7D5W_EDO_E_202 86% 91% 0.113 0.9820.45 0.12 - -00100%1
7D5W_EDO_O_303 85% 68% 0.11 0.9760.76 0.48 - -00100%1
7D5W_EDO_N_613 84% 67% 0.104 0.9670.63 0.64 - -00100%1
7D5W_EDO_N_617 84% 90% 0.115 0.9770.46 0.15 - -00100%1
7D5W_EDO_F_106 84% 70% 0.109 0.970.61 0.54 - -00100%1
7D5W_EDO_A_619 83% 89% 0.122 0.9810.48 0.16 - -00100%1
7D5W_EDO_F_104 83% 78% 0.128 0.9860.58 0.33 - -00100%1
7D5W_EDO_A_615 83% 57% 0.106 0.9630.68 0.98 - -00100%1
7D5W_EDO_P_312 82% 63% 0.111 0.9670.44 0.97 - -00100%1
7D5W_EDO_E_201 80% 82% 0.126 0.9770.56 0.25 - -00100%1
7D5W_EDO_T_103 78% 72% 0.108 0.9490.73 0.36 - -00100%1
7D5W_EDO_A_613 77% 62% 0.139 0.9780.79 0.68 - -00100%1
7D5W_EDO_S_105 74% 65% 0.143 0.9730.64 0.71 - -00100%1
7D5W_EDO_B_304 74% 76% 0.145 0.9750.4 0.53 - -00100%1
7D5W_EDO_D_203 72% 86% 0.139 0.9620.5 0.22 - -00100%1
7D5W_EDO_N_614 71% 81% 0.109 0.9290.65 0.18 - -00100%1
7D5W_EDO_E_203 71% 79% 0.124 0.9440.46 0.4 - -00100%1
7D5W_EDO_N_618 70% 80% 0.159 0.9770.53 0.32 - -00100%1
7D5W_EDO_D_202 68% 82% 0.155 0.9660.5 0.31 - -00100%1
7D5W_EDO_F_107 66% 79% 0.149 0.9540.5 0.38 - -00100%1
7D5W_EDO_T_105 65% 77% 0.15 0.9510.62 0.32 - -00100%1
7D5W_EDO_S_107 63% 71% 0.179 0.9770.52 0.58 - -00100%1
7D5W_EDO_S_106 63% 66% 0.143 0.9390.37 0.91 - -10100%1
7D5W_EDO_Y_101 61% 90% 0.148 0.9380.46 0.17 - -10100%1
7D5W_EDO_N_616 61% 72% 0.159 0.9490.4 0.69 - -00100%1
7D5W_EDO_O_304 61% 86% 0.134 0.9230.65 0.08 - -00100%1
7D5W_EDO_F_108 60% 80% 0.156 0.9430.48 0.37 - -00100%1
7D5W_EDO_P_311 60% 79% 0.134 0.9190.7 0.18 - -00100%1
7D5W_EDO_C_312 60% 76% 0.117 0.90.63 0.34 - -00100%1
7D5W_EDO_C_314 55% 74% 0.179 0.9480.34 0.67 - -00100%1
7D5W_EDO_C_316 54% 86% 0.132 0.8970.38 0.35 - -00100%1
7D5W_EDO_S_104 54% 67% 0.128 0.8920.49 0.77 - -00100%1
7D5W_EDO_B_306 54% 78% 0.152 0.9150.57 0.32 - -00100%1
7D5W_EDO_Q_202 51% 77% 0.166 0.9220.54 0.39 - -00100%1
7D5W_EDO_F_102 51% 75% 0.108 0.8620.56 0.43 - -00100%1
7D5W_EDO_N_622 51% 74% 0.181 0.9340.75 0.28 - -00100%1
7D5W_EDO_A_621 50% 71% 0.173 0.9250.61 0.51 - -00100%1
7D5W_EDO_C_313 50% 70% 0.135 0.8840.8 0.35 - -00100%1
7D5W_EDO_F_103 49% 75% 0.135 0.8810.47 0.52 - -00100%1
7D5W_EDO_J_102 49% 88% 0.169 0.9160.51 0.16 - -00100%1
7D5W_EDO_C_318 48% 78% 0.196 0.9390.56 0.35 - -10100%1
7D5W_EDO_F_109 45% 64% 0.193 0.9260.61 0.75 - -00100%1
7D5W_EDO_B_305 45% 82% 0.135 0.8660.71 0.1 - -00100%1
7D5W_EDO_P_313 45% 63% 0.183 0.9140.43 0.97 - -00100%1
7D5W_EDO_A_622 45% 70% 0.217 0.9490.56 0.61 - -00100%1
7D5W_EDO_N_619 40% 88% 0.153 0.8650.56 0.13 - -00100%1
7D5W_EDO_D_201 40% 80% 0.211 0.9220.57 0.29 - -00100%1
7D5W_EDO_W_101 38% 80% 0.184 0.8860.38 0.45 - -00100%1
7D5W_EDO_A_614 36% 86% 0.19 0.8850.45 0.28 - -00100%1
7D5W_EDO_P_314 35% 87% 0.14 0.8280.57 0.14 - -00100%1
7D5W_EDO_P_309 35% 86% 0.177 0.8660.53 0.21 - -00100%1
7D5W_EDO_W_102 34% 76% 0.236 0.9220.49 0.45 - -00100%1
7D5W_EDO_N_621 32% 80% 0.294 0.970.34 0.5 - -10100%1
7D5W_EDO_A_620 27% 82% 0.189 0.8360.67 0.14 - -10100%1
7D5W_EDO_C_311 24% 87% 0.163 0.7930.53 0.17 - -00100%1
7D5W_EDO_C_319 24% 78% 0.246 0.8760.6 0.31 - -00100%1
7D5W_EDO_J_103 23% 71% 0.259 0.8810.36 0.76 - -00100%1
7D5W_EDO_P_315 22% 89% 0.165 0.7820.53 0.13 - -00100%1
7D5W_EDO_N_620 20% 86% 0.198 0.7960.58 0.15 - -10100%1
7D5W_EDO_D_204 19% 76% 0.322 0.9220.5 0.46 - -30100%1
7D5W_EDO_L_103 18% 67% 0.219 0.8030.24 1.02 - -00100%1
7D5W_EDO_O_305 18% 89% 0.19 0.7720.55 0.11 - -00100%1
7D5W_EDO_A_616 18% 76% 0.318 0.9040.45 0.5 - -10100%1
7D5W_EDO_D_205 16% 84% 0.326 0.8980.37 0.39 - -20100%1
7D5W_EDO_L_104 16% 72% 0.237 0.8050.59 0.49 - -00100%1
7D5W_EDO_A_612 16% 73% 0.236 0.8020.71 0.35 - -20100%1
7D5W_EDO_M_102 15% 83% 0.333 0.8980.45 0.34 - -00100%1
7D5W_EDO_A_617 13% 72% 0.269 0.8150.5 0.59 - -00100%1
7D5W_EDO_C_317 12% 88% 0.182 0.7130.54 0.15 - -00100%1
7D5W_EDO_T_104 11% 84% 0.263 0.7750.49 0.28 - -00100%1
7D5W_EDO_F_105 9% 80% 0.179 0.6610.62 0.23 - -00100%1
7D5W_EDO_C_320 6% 70% 0.347 0.7910.71 0.45 - -00100%1
7D5W_EDO_C_315 6% 86% 0.234 0.6560.56 0.18 - -10100%1
7D5W_EDO_P_310 4% 86% 0.172 0.543 0.54 0.19 - -00100%1
7D5W_EDO_A_618 3% 74% 0.263 0.5770.75 0.29 - -10100%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
7W3E_EDO_G_103 98% 67% 0.058 0.9790.72 0.56 - -00100%1
5ZCP_EDO_S_102 97% 61% 0.072 0.9871.07 0.43 - -00100%1
6ANS_EDO_A_404 100% 89% 0.029 0.9950.57 0.07 - -00100%1
4ITB_EDO_A_503 100% 88% 0.028 0.990.38 0.29 - -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