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
5NSL_EDO_B_2031 48% 84% 0.11 0.8510.54 0.23 - -00100%1
5NSL_EDO_A_2033 48% 88% 0.151 0.8930.48 0.19 - -00100%1
5NSL_EDO_B_2035 29% 84% 0.187 0.8430.54 0.24 - -00100%1
5NSL_EDO_B_2054 24% 79% 0.228 0.8580.55 0.32 - -00100%1
5NSL_EDO_B_2034 23% 91% 0.17 0.7930.46 0.11 - -00100%1
5NSL_EDO_A_2040 22% 90% 0.182 0.7970.5 0.13 - -00100%1
5NSL_EDO_A_2037 20% 87% 0.197 0.7950.46 0.25 - -00100%0.5
5NSL_EDO_A_2047 19% 89% 0.25 0.8450.53 0.13 - -00100%1
5NSL_EDO_A_2034 18% 85% 0.157 0.7440.53 0.23 - -00100%1
5NSL_EDO_B_2036 18% 88% 0.184 0.7680.5 0.19 - -00100%1
5NSL_EDO_B_2055 17% 90% 0.222 0.8010.5 0.12 - -00100%1
5NSL_EDO_B_2042 16% 87% 0.237 0.810.51 0.19 - -00100%1
5NSL_EDO_A_2052 16% 89% 0.175 0.7430.51 0.13 - -00100%1
5NSL_EDO_A_2056 13% 87% 0.24 0.7840.53 0.17 - -10100%1
5NSL_EDO_A_2039 13% 81% 0.15 0.6880.46 0.37 - -00100%1
5NSL_EDO_A_2060 13% 81% 0.305 0.8460.55 0.28 - -00100%1
5NSL_EDO_B_2038 13% 85% 0.282 0.8210.51 0.23 - -00100%1
5NSL_EDO_B_2043 13% 88% 0.192 0.7260.51 0.16 - -00100%1
5NSL_EDO_A_2038 12% 80% 0.233 0.760.55 0.3 - -00100%1
5NSL_EDO_A_2035 11% 76% 0.203 0.7220.47 0.48 - -00100%1
5NSL_EDO_B_2044 10% 86% 0.258 0.7650.55 0.19 - -10100%0.8
5NSL_EDO_B_2030 10% 84% 0.27 0.7760.5 0.27 - -00100%1
5NSL_EDO_A_2051 8% 89% 0.242 0.7130.5 0.15 - -00100%1
5NSL_EDO_A_2057 7% 88% 0.202 0.6640.49 0.2 - -00100%1
5NSL_EDO_B_2047 7% 87% 0.186 0.6310.56 0.15 - -20100%1
5NSL_EDO_B_2056 7% 85% 0.367 0.8160.45 0.29 - -00100%1
5NSL_EDO_B_2061 7% 87% 0.211 0.6550.46 0.25 - -00100%0.5
5NSL_EDO_A_2041 6% 94% 0.295 0.7370.33 0.11 - -00100%0.8
5NSL_EDO_A_2048 5% 86% 0.29 0.7060.51 0.22 - -00100%1
5NSL_EDO_B_2058 5% 87% 0.305 0.7040.46 0.24 - -00100%0.5
5NSL_EDO_A_2059 4% 80% 0.271 0.660.55 0.31 - -00100%1
5NSL_EDO_A_2055 4% 90% 0.279 0.660.52 0.1 - -00100%1
5NSL_EDO_A_2045 4% 85% 0.275 0.6540.56 0.2 - -00100%0.8
5NSL_EDO_B_2053 3% 82% 0.265 0.6040.64 0.18 - -10100%1
5NSL_EDO_B_2037 3% 87% 0.289 0.6280.53 0.18 - -00100%1
5NSL_EDO_A_2049 3% 90% 0.269 0.6020.49 0.13 - -00100%0.9
5NSL_EDO_A_2050 3% 89% 0.229 0.554 0.51 0.15 - -00100%1
5NSL_EDO_A_2042 3% 84% 0.227 0.545 0.54 0.24 - -00100%1
5NSL_EDO_B_2057 2% 88% 0.353 0.6460.51 0.18 - -00100%1
5NSL_EDO_A_2032 2% 78% 0.299 0.5860.4 0.5 - -30100%0.9
5NSL_EDO_B_2046 2% 89% 0.264 0.531 0.53 0.13 - -00100%1
5NSL_EDO_A_2053 2% 90% 0.323 0.557 0.51 0.1 - -30100%1
5O47_EDO_A_2006 43% 82% 0.144 0.8670.52 0.28 - -00100%1
6FJG_EDO_B_1004 30% 84% 0.153 0.8160.54 0.24 - -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