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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
9KUK_EDO_F_103 | 95% | 94% | 0.082 | 0.984 | 0.2 | 0.24 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_S_103 | 94% | 99% | 0.082 | 0.983 | 0.1 | 0.14 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_B_306 | 91% | 93% | 0.089 | 0.974 | 0.19 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_T_104 | 79% | 96% | 0.11 | 0.956 | 0.27 | 0.08 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_S_102 | 76% | 79% | 0.108 | 0.943 | 0.54 | 0.34 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_N_615 | 71% | 94% | 0.142 | 0.964 | 0.3 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_O_308 | 71% | 95% | 0.125 | 0.945 | 0.08 | 0.31 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_G_104 | 64% | 93% | 0.135 | 0.934 | 0.35 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_N_612 | 62% | 91% | 0.137 | 0.929 | 0.39 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_A_615 | 61% | 92% | 0.132 | 0.922 | 0.26 | 0.28 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_A_614 | 60% | 79% | 0.17 | 0.957 | 0.61 | 0.26 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_P_322 | 58% | 97% | 0.181 | 0.962 | 0.2 | 0.11 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_F_102 | 53% | 94% | 0.16 | 0.923 | 0.29 | 0.17 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_C_321 | 52% | 93% | 0.183 | 0.942 | 0.19 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_A_612 | 48% | 91% | 0.155 | 0.898 | 0.34 | 0.23 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_N_614 | 48% | 89% | 0.19 | 0.932 | 0.38 | 0.27 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_E_202 | 47% | 96% | 0.204 | 0.946 | 0.21 | 0.14 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_R_202 | 47% | 98% | 0.188 | 0.926 | 0.09 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_N_616 | 44% | 76% | 0.206 | 0.935 | 0.5 | 0.45 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_R_201 | 39% | 99% | 0.248 | 0.956 | 0.14 | 0.06 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_E_203 | 35% | 97% | 0.236 | 0.928 | 0.1 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_C_320 | 34% | 98% | 0.256 | 0.942 | 0.13 | 0.16 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_P_321 | 32% | 96% | 0.219 | 0.893 | 0.26 | 0.09 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_R_203 | 32% | 80% | 0.243 | 0.917 | 0.37 | 0.46 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_N_613 | 19% | 97% | 0.28 | 0.88 | 0.09 | 0.23 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_A_613 | 9% | 91% | 0.313 | 0.809 | 0.28 | 0.3 | - | - | 1 | 0 | 100% | 0.5 |
9KUK_EDO_C_322 | 8% | 51% | 0.314 | 0.783 | 0.98 | 0.92 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_E_201 | 7% | 98% | 0.359 | 0.819 | 0.09 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9KUK_EDO_P_323 | 3% | 66% | 0.347 | 0.702 | 0.36 | 0.95 | - | - | 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 |