3SMR
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
3SMR_EDO_A_2004 | 90% | 80% | 0.081 | 0.965 | 0.42 | 0.43 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_B_2000 | 80% | 78% | 0.088 | 0.937 | 0.41 | 0.48 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2020 | 78% | 83% | 0.109 | 0.952 | 0.43 | 0.36 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_C_2021 | 78% | 82% | 0.093 | 0.935 | 0.43 | 0.37 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_B_2006 | 70% | 82% | 0.117 | 0.934 | 0.45 | 0.35 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_D_2012 | 68% | 77% | 0.109 | 0.921 | 0.43 | 0.48 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_D_2011 | 67% | 81% | 0.11 | 0.917 | 0.41 | 0.42 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2013 | 64% | 80% | 0.121 | 0.919 | 0.44 | 0.4 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_C_2008 | 58% | 81% | 0.15 | 0.929 | 0.43 | 0.39 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_C_2017 | 57% | 82% | 0.169 | 0.946 | 0.46 | 0.34 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_D_2016 | 54% | 92% | 0.184 | 0.949 | 0.44 | 0.12 | - | - | 1 | 0 | 100% | 0.8 |
3SMR_EDO_B_2007 | 43% | 85% | 0.217 | 0.94 | 0.43 | 0.32 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_C_2010 | 41% | 80% | 0.127 | 0.84 | 0.45 | 0.4 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2018 | 39% | 89% | 0.135 | 0.842 | 0.48 | 0.16 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2015 | 32% | 81% | 0.166 | 0.841 | 0.44 | 0.39 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_D_2019 | 26% | 85% | 0.216 | 0.857 | 0.41 | 0.34 | - | - | 2 | 0 | 100% | 0.8 |
3SMR_EDO_C_2009 | 16% | 77% | 0.162 | 0.732 | 0.48 | 0.44 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_B_2001 | 15% | 83% | 0.171 | 0.731 | 0.46 | 0.32 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2014 | 10% | 88% | 0.255 | 0.765 | 0.47 | 0.2 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_B_2005 | 10% | 89% | 0.383 | 0.889 | 0.47 | 0.17 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_B_2022 | 6% | 84% | 0.29 | 0.728 | 0.46 | 0.3 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2002 | 5% | 78% | 0.367 | 0.776 | 0.41 | 0.47 | - | - | 0 | 0 | 100% | 0.8 |
3SMR_EDO_A_2003 | 1% | 81% | 0.584 | 0.779 | 0.44 | 0.39 | - | - | 1 | 0 | 100% | 0.8 |
5EAM_EDO_B_405 | 92% | 78% | 0.067 | 0.959 | 0.46 | 0.43 | - | - | 0 | 0 | 100% | 1 |
5EAL_EDO_B_403 | 87% | 79% | 0.083 | 0.955 | 0.36 | 0.5 | - | - | 0 | 0 | 100% | 0.8 |
8T5I_EDO_A_404 | 87% | 92% | 0.086 | 0.958 | 0.17 | 0.36 | - | - | 0 | 0 | 100% | 1 |
5VFC_EDO_A_405 | 87% | 82% | 0.075 | 0.945 | 0.49 | 0.32 | - | - | 0 | 0 | 100% | 1 |
8BB3_EDO_B_408 | 84% | 80% | 0.087 | 0.948 | 0.42 | 0.42 | - | - | 0 | 0 | 100% | 1 |
2G8S_EDO_A_3016 | 100% | 84% | 0.02 | 0.992 | 0.42 | 0.35 | - | - | 0 | 0 | 100% | 0.7 |
3DPJ_EDO_B_195 | 100% | 82% | 0.022 | 0.994 | 0.47 | 0.34 | - | - | 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 |