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) |
Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
---|---|---|---|---|---|---|---|---|---|---|---|---|
9M56_EDO_F_104 | 97% | 95% | 0.067 | 0.985 | 0.1 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_B_305 | 95% | 95% | 0.076 | 0.981 | 0.11 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_T_105 | 91% | 90% | 0.086 | 0.973 | 0.37 | 0.24 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_O_308 | 85% | 92% | 0.1 | 0.964 | 0.11 | 0.43 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_R_202 | 85% | 89% | 0.11 | 0.974 | 0.28 | 0.36 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_S_103 | 83% | 95% | 0.107 | 0.965 | 0.19 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_N_612 | 77% | 92% | 0.119 | 0.96 | 0.27 | 0.24 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_G_105 | 77% | 81% | 0.117 | 0.957 | 0.52 | 0.3 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_P_322 | 71% | 91% | 0.146 | 0.967 | 0.38 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_S_102 | 68% | 80% | 0.113 | 0.925 | 0.38 | 0.45 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_E_202 | 66% | 96% | 0.147 | 0.954 | 0.24 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_C_321 | 63% | 93% | 0.15 | 0.946 | 0.33 | 0.17 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_E_203 | 58% | 99% | 0.166 | 0.945 | 0.11 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_N_611 | 58% | 74% | 0.179 | 0.957 | 0.64 | 0.39 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_A_612 | 56% | 78% | 0.185 | 0.958 | 0.56 | 0.33 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_F_103 | 55% | 90% | 0.15 | 0.919 | 0.49 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_N_609 | 50% | 76% | 0.155 | 0.905 | 0.52 | 0.44 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_R_203 | 45% | 92% | 0.2 | 0.934 | 0.22 | 0.31 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_A_610 | 44% | 69% | 0.167 | 0.896 | 0.63 | 0.57 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_F_101 | 44% | 94% | 0.184 | 0.912 | 0.33 | 0.1 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_P_321 | 40% | 98% | 0.198 | 0.909 | 0.18 | 0.12 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_N_613 | 37% | 87% | 0.232 | 0.931 | 0.65 | 0.05 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_N_610 | 30% | 92% | 0.216 | 0.881 | 0.15 | 0.39 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_R_201 | 30% | 97% | 0.294 | 0.959 | 0.15 | 0.15 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_A_611 | 19% | 93% | 0.269 | 0.863 | 0.19 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_C_322 | 12% | 56% | 0.293 | 0.828 | 0.87 | 0.83 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_E_201 | 9% | 98% | 0.338 | 0.83 | 0.18 | 0.11 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_C_320 | 9% | 99% | 0.372 | 0.86 | 0.15 | 0.08 | - | - | 0 | 0 | 100% | 0.5 |
9M56_EDO_P_323 | 4% | 69% | 0.362 | 0.75 | 0.42 | 0.75 | - | - | 0 | 0 | 100% | 0.5 |
5B1B_EDO_B_303 | 100% | 77% | 0.04 | 0.984 | 0.57 | 0.35 | - | - | 0 | 0 | 100% | 1 |
3AG2_EDO_F_102 | 100% | 66% | 0.046 | 0.989 | 0.9 | 0.43 | - | - | 0 | 0 | 100% | 1 |
7YPY_EDO_S_106 | 100% | 84% | 0.044 | 0.985 | 0.7 | 0.08 | - | - | 0 | 0 | 100% | 1 |
5ZCQ_EDO_E_203 | 98% | 62% | 0.057 | 0.983 | 0.5 | 0.93 | - | - | 0 | 0 | 100% | 1 |
7VVR_EDO_F_102 | 98% | 56% | 0.063 | 0.989 | 1.04 | 0.66 | - | - | 0 | 0 | 100% | 1 |
2G8S_EDO_A_3016 | 100% | 84% | 0.02 | 0.992 | 0.42 | 0.35 | - | - | 0 | 0 | 100% | 0.5 |
3DPJ_EDO_F_193 | 100% | 76% | 0.023 | 0.995 | 0.41 | 0.53 | - | - | 1 | 0 | 100% | 1 |
4EYG_EDO_A_402 | 100% | 81% | 0.024 | 0.995 | 0.44 | 0.39 | - | - | 0 | 0 | 100% | 1 |
4NMU_EDO_D_206 | 100% | 92% | 0.025 | 0.997 | 0.38 | 0.14 | - | - | 0 | 0 | 100% | 1 |
4Q6J_EDO_A_302 | 100% | 82% | 0.013 | 0.999 | 0.37 | 0.42 | - | - | 0 | 0 | 100% | 1 |