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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
9KUM_EDO_B_306 | 94% | 92% | 0.081 | 0.98 | 0.13 | 0.37 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_S_103 | 91% | 97% | 0.092 | 0.978 | 0.11 | 0.21 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_S_102 | 90% | 92% | 0.09 | 0.972 | 0.34 | 0.2 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_F_104 | 86% | 96% | 0.108 | 0.978 | 0.23 | 0.13 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_T_106 | 82% | 91% | 0.115 | 0.969 | 0.34 | 0.24 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_O_310 | 78% | 95% | 0.113 | 0.957 | 0.14 | 0.26 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_P_321 | 75% | 89% | 0.141 | 0.975 | 0.34 | 0.3 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_R_202 | 71% | 89% | 0.157 | 0.978 | 0.16 | 0.47 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_N_614 | 67% | 96% | 0.16 | 0.97 | 0.14 | 0.23 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_G_103 | 62% | 99% | 0.155 | 0.948 | 0.16 | 0.05 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_C_321 | 62% | 91% | 0.179 | 0.972 | 0.42 | 0.15 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_N_611 | 61% | 93% | 0.151 | 0.939 | 0.31 | 0.19 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_F_103 | 55% | 92% | 0.163 | 0.93 | 0.24 | 0.29 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_F_101 | 54% | 75% | 0.186 | 0.951 | 0.46 | 0.52 | - | - | 1 | 0 | 100% | 0.5 |
9KUM_EDO_N_615 | 52% | 90% | 0.192 | 0.951 | 0.32 | 0.3 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_N_613 | 49% | 92% | 0.201 | 0.949 | 0.38 | 0.15 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_A_612 | 48% | 80% | 0.198 | 0.941 | 0.67 | 0.19 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_P_320 | 37% | 90% | 0.225 | 0.922 | 0.38 | 0.22 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_E_203 | 31% | 100% | 0.25 | 0.921 | 0.11 | 0.03 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_E_202 | 31% | 98% | 0.256 | 0.926 | 0.15 | 0.12 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_R_201 | 27% | 98% | 0.299 | 0.95 | 0.15 | 0.14 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_A_610 | 27% | 98% | 0.215 | 0.861 | 0.23 | 0.05 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_R_203 | 25% | 78% | 0.237 | 0.874 | 0.5 | 0.4 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_E_201 | 23% | 96% | 0.265 | 0.889 | 0.13 | 0.24 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_N_612 | 23% | 92% | 0.236 | 0.858 | 0.37 | 0.16 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_C_320 | 21% | 98% | 0.29 | 0.898 | 0.1 | 0.16 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_C_322 | 16% | 53% | 0.303 | 0.871 | 1.14 | 0.71 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_A_611 | 11% | 86% | 0.313 | 0.836 | 0.27 | 0.44 | - | - | 0 | 0 | 100% | 0.5 |
9KUM_EDO_P_322 | 6% | 64% | 0.347 | 0.773 | 0.52 | 0.84 | - | - | 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 |