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
5Z86_EDO_C_312 93% 81% 0.09 0.9860.51 0.32 - -00100%1
5Z86_EDO_G_105 91% 86% 0.099 0.9850.53 0.21 - -00100%1
5Z86_EDO_S_102 91% 82% 0.1 0.9860.52 0.29 - -00100%1
5Z86_EDO_E_203 89% 80% 0.107 0.9850.45 0.39 - -00100%1
5Z86_EDO_F_102 87% 82% 0.12 0.9920.51 0.3 - -00100%1
5Z86_EDO_N_615 83% 83% 0.119 0.9770.43 0.35 - -00100%1
5Z86_EDO_E_205 78% 85% 0.115 0.9580.46 0.28 - -00100%1
5Z86_EDO_B_304 77% 86% 0.137 0.9770.46 0.27 - -00100%1
5Z86_EDO_N_614 75% 80% 0.113 0.9470.58 0.28 - -00100%1
5Z86_EDO_R_203 71% 81% 0.121 0.9430.47 0.36 - -00100%1
5Z86_EDO_E_202 71% 83% 0.131 0.9530.49 0.3 - -00100%1
5Z86_EDO_F_103 71% 82% 0.124 0.9450.47 0.33 - -00100%1
5Z86_EDO_T_103 58% 81% 0.178 0.9570.54 0.28 - -00100%1
5Z86_EDO_A_621 56% 82% 0.197 0.9720.44 0.37 - -10100%1
5Z86_EDO_A_610 53% 78% 0.207 0.970.41 0.47 - -00100%1
5Z86_EDO_O_304 53% 79% 0.157 0.9170.43 0.44 - -00100%1
5Z86_EDO_O_303 52% 79% 0.217 0.9750.46 0.42 - -00100%1
5Z86_EDO_D_205 51% 86% 0.198 0.9550.44 0.29 - -00100%1
5Z86_EDO_N_612 51% 81% 0.192 0.9480.47 0.36 - -00100%1
5Z86_EDO_P_313 46% 85% 0.239 0.9780.53 0.23 - -00100%1
5Z86_EDO_S_104 44% 78% 0.212 0.9410.39 0.51 - -10100%1
5Z86_EDO_N_616 43% 85% 0.146 0.870.5 0.24 - -10100%1
5Z86_EDO_N_613 43% 79% 0.199 0.9230.4 0.47 - -00100%1
5Z86_EDO_V_101 43% 81% 0.18 0.9020.44 0.39 - -00100%1
5Z86_EDO_Q_202 41% 80% 0.223 0.940.43 0.42 - -00100%1
5Z86_EDO_D_206 41% 79% 0.194 0.9090.41 0.45 - -00100%1
5Z86_EDO_A_612 40% 78% 0.2 0.910.36 0.54 - -30100%1
5Z86_EDO_R_202 39% 80% 0.207 0.9160.46 0.39 - -00100%1
5Z86_EDO_N_610 38% 84% 0.152 0.8550.45 0.31 - -00100%1
5Z86_EDO_A_611 37% 78% 0.21 0.9060.45 0.45 - -10100%1
5Z86_EDO_C_319 36% 87% 0.218 0.9130.51 0.19 - -00100%1
5Z86_EDO_A_615 34% 79% 0.189 0.8730.54 0.33 - -00100%1
5Z86_EDO_N_618 33% 84% 0.254 0.9320.47 0.3 - -00100%1
5Z86_EDO_A_613 32% 78% 0.219 0.8950.42 0.47 - -00100%1
5Z86_EDO_P_312 32% 84% 0.211 0.8860.48 0.28 - -10100%1
5Z86_EDO_R_201 31% 81% 0.213 0.8840.42 0.41 - -00100%1
5Z86_EDO_P_314 29% 81% 0.291 0.9520.43 0.39 - -00100%1
5Z86_EDO_E_206 28% 80% 0.26 0.9160.45 0.39 - -00100%1
5Z86_EDO_N_619 28% 80% 0.246 0.90.44 0.41 - -00100%1
5Z86_EDO_U_101 25% 82% 0.168 0.8020.45 0.35 - -00100%1
5Z86_EDO_R_205 24% 84% 0.254 0.8850.52 0.25 - -00100%1
5Z86_EDO_A_616 23% 80% 0.232 0.8540.44 0.41 - -00100%1
5Z86_EDO_A_614 22% 59% 0.189 0.8050.52 1.03 - -10100%1
5Z86_EDO_C_315 20% 73% 0.256 0.8620.42 0.63 - -20100%1
5Z86_EDO_H_101 20% 76% 0.165 0.7680.41 0.54 - -10100%1
5Z86_EDO_E_204 20% 78% 0.25 0.8550.39 0.51 - -00100%1
5Z86_EDO_W_102 19% 80% 0.31 0.910.42 0.42 - -00100%1
5Z86_EDO_F_104 19% 84% 0.283 0.8760.43 0.33 - -00100%1
5Z86_EDO_C_313 17% 81% 0.188 0.7690.46 0.36 - -00100%1
5Z86_EDO_G_104 17% 81% 0.199 0.7760.42 0.4 - -00100%1
5Z86_EDO_J_102 15% 81% 0.154 0.7160.45 0.38 - -00100%1
5Z86_EDO_S_103 14% 78% 0.314 0.8680.44 0.46 - -00100%1
5Z86_EDO_N_617 13% 90% 0.32 0.8650.49 0.14 - -10100%1
5Z86_EDO_O_305 12% 82% 0.175 0.6990.45 0.35 - -00100%1
5Z86_EDO_C_314 9% 81% 0.257 0.7520.46 0.37 - -00100%1
5Z86_EDO_N_620 9% 80% 0.337 0.8310.47 0.37 - -00100%1
5Z86_EDO_G_106 8% 86% 0.235 0.7120.48 0.24 - -00100%1
5Z86_EDO_C_316 7% 83% 0.195 0.6490.47 0.32 - -00100%1
5Z86_EDO_A_620 6% 72% 0.469 0.9070.37 0.71 - -00100%1
5Z86_EDO_Q_203 5% 77% 0.346 0.7660.49 0.44 - -00100%1
5Z86_EDO_R_204 5% 80% 0.421 0.8210.46 0.39 - -00100%1
5Z86_EDO_N_611 5% 78% 0.369 0.7670.52 0.37 - -10100%1
5Z86_EDO_A_617 4% 80% 0.423 0.7990.4 0.44 - -20100%1
5Z86_EDO_A_619 4% 83% 0.217 0.5790.49 0.29 - -00100%1
5Z86_EDO_Q_204 3% 88% 0.218 0.531 0.48 0.2 - -10100%1
5Z86_EDO_D_204 2% 85% 0.334 0.6080.5 0.25 - -00100%1
5Z86_EDO_A_618 1% 84% 0.53 0.7580.46 0.31 - -10100%1
5Z86_EDO_D_203 1% 91% 0.377 0.541 0.47 0.12 - -30100%1
5Z86_EDO_C_317 1% 83% 0.389 0.5 0.48 0.31 - -00100%1
5Z86_EDO_D_202 1% 79% 0.703 0.8090.34 0.53 - -50100%1
5Z86_EDO_C_318 0% 84% 0.919 0.236 0.48 0.29 - -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
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