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
6H0B_EDO_A_602 93% 73% 0.074 0.970.32 0.7 - -00100%1
6H0B_EDO_A_603 86% 73% 0.101 0.9710.43 0.61 - -00100%1
6H0B_EDO_A_617 84% 91% 0.089 0.950.3 0.26 - -00100%1
6H0B_EDO_B_603 81% 74% 0.122 0.9730.77 0.26 - -00100%1
6H0B_EDO_A_612 80% 52% 0.097 0.9440.42 1.42 - -20100%1
6H0B_EDO_A_607 73% 87% 0.136 0.9630.46 0.24 - -20100%1
6H0B_EDO_B_605 71% 82% 0.115 0.9340.61 0.21 - -00100%1
6H0B_EDO_A_606 66% 86% 0.134 0.940.48 0.24 - -00100%1
6H0B_EDO_B_612 57% 45% 0.122 0.8960.66 1.44 - -00100%1
6H0B_EDO_B_611 55% 75% 0.14 0.9070.41 0.57 - -00100%1
6H0B_EDO_A_613 54% 77% 0.122 0.8870.43 0.49 - -10100%1
6H0B_EDO_A_609 46% 82% 0.163 0.8970.58 0.23 - -00100%1
6H0B_EDO_B_616 43% 79% 0.183 0.9070.34 0.53 - -00100%1
6H0B_EDO_B_619 43% 84% 0.142 0.8630.52 0.25 - -00100%1
6H0B_EDO_B_615 41% 78% 0.142 0.8550.47 0.43 - -00100%1
6H0B_EDO_B_606 40% 82% 0.114 0.8230.6 0.22 - -00100%1
6H0B_EDO_B_604 34% 77% 0.145 0.8250.35 0.55 - -00100%1
6H0B_EDO_A_605 32% 81% 0.224 0.8990.36 0.45 - -00100%1
6H0B_EDO_A_601 28% 64% 0.217 0.8690.44 0.93 - -00100%1
6H0B_EDO_B_613 28% 84% 0.163 0.8130.58 0.2 - -00100%1
6H0B_EDO_B_608 27% 82% 0.179 0.8250.34 0.46 - -00100%1
6H0B_EDO_A_616 27% 77% 0.186 0.8310.5 0.43 - -00100%1
6H0B_EDO_A_604 26% 72% 0.307 0.9510.57 0.52 - -00100%1
6H0B_EDO_A_610 25% 71% 0.186 0.820.46 0.65 - -00100%1
6H0B_EDO_B_607 22% 77% 0.268 0.8870.53 0.39 - -00100%1
6H0B_EDO_A_608 18% 88% 0.176 0.7610.54 0.13 - -20100%1
6H0B_EDO_A_614 16% 82% 0.192 0.7610.42 0.39 - -00100%1
6H0B_EDO_A_611 7% 79% 0.289 0.750.75 0.14 - -10100%1
6H0B_EDO_B_609 7% 74% 0.29 0.7390.37 0.62 - -00100%1
6H0B_EDO_A_615 7% 76% 0.186 0.6290.51 0.43 - -00100%1
6H0B_EDO_A_618 6% 82% 0.338 0.7770.46 0.34 - -20100%1
6H0B_EDO_B_620 5% 70% 0.509 0.9210.28 0.86 - -30100%1
6H0B_EDO_B_614 1% 71% 0.313 0.539 0.49 0.63 - -00100%1
6H0B_EDO_B_610 1% 76% 0.317 0.53 0.44 0.5 - -00100%1
6H0B_EDO_B_617 1% 79% 0.522 0.7250.66 0.23 - -00100%1
6H0B_EDO_B_618 0% 81% 0.397 0.428 0.52 0.31 - -00100%1
5NQA_EDO_A_630 71% 92% 0.112 0.9310.5 0.06 - -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