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
3SL4_EDO_D_4 80% 87% 0.098 0.9480.53 0.18 - -00100%1
3SL4_EDO_D_7 75% 82% 0.107 0.9410.42 0.39 - -00100%1
3SL4_EDO_A_14 74% 78% 0.105 0.9360.41 0.49 - -00100%1
3SL4_EDO_A_4 71% 78% 0.11 0.9290.43 0.45 - -00100%1
3SL4_EDO_A_13 67% 77% 0.129 0.9360.39 0.53 - -00100%1
3SL4_EDO_C_6 60% 77% 0.129 0.9140.49 0.44 - -00100%1
3SL4_EDO_C_4 59% 85% 0.132 0.9150.49 0.26 - -00100%1
3SL4_EDO_A_7 59% 77% 0.115 0.8950.45 0.46 - -30100%1
3SL4_EDO_B_10 55% 69% 0.133 0.9010.46 0.72 - -00100%1
3SL4_EDO_C_440 54% 82% 0.141 0.9050.44 0.37 - -30100%1
3SL4_EDO_A_5 50% 81% 0.131 0.8790.49 0.33 - -00100%1
3SL4_EDO_D_5 43% 77% 0.174 0.8970.42 0.5 - -50100%1
3SL4_EDO_D_11 42% 87% 0.178 0.8980.54 0.17 - -00100%1
3SL4_EDO_C_5 42% 80% 0.179 0.8970.4 0.44 - -10100%1
3SL4_EDO_A_10 39% 80% 0.18 0.8870.44 0.41 - -20100%1
3SL4_EDO_C_11 38% 81% 0.149 0.8480.5 0.32 - -10100%1
3SL4_EDO_C_12 38% 83% 0.181 0.8810.51 0.27 - -20100%1
3SL4_EDO_B_13 37% 78% 0.171 0.870.52 0.38 - -00100%1
3SL4_EDO_D_440 37% 81% 0.171 0.8670.56 0.27 - -00100%1
3SL4_EDO_B_4 36% 77% 0.164 0.8570.48 0.44 - -10100%1
3SL4_EDO_B_9 36% 85% 0.143 0.8340.5 0.25 - -00100%1
3SL4_EDO_A_18 35% 81% 0.223 0.910.51 0.31 - -20100%1
3SL4_EDO_D_17 34% 76% 0.202 0.8880.5 0.44 - -20100%1
3SL4_EDO_B_8 33% 77% 0.195 0.8740.41 0.5 - -00100%1
3SL4_EDO_C_8 28% 73% 0.202 0.8530.52 0.53 - -10100%1
3SL4_EDO_B_11 27% 71% 0.264 0.9130.47 0.65 - -00100%1
3SL4_EDO_B_18 27% 92% 0.228 0.8740.52 0.04 - -50100%1
3SL4_EDO_A_11 25% 77% 0.252 0.8880.48 0.43 - -00100%1
3SL4_EDO_B_17 25% 79% 0.246 0.8810.46 0.41 - -00100%1
3SL4_EDO_A_17 24% 74% 0.229 0.8560.44 0.58 - -10100%1
3SL4_EDO_B_16 23% 81% 0.317 0.9450.38 0.44 - -60100%1
3SL4_EDO_D_15 21% 80% 0.266 0.8790.5 0.34 - -30100%1
3SL4_EDO_C_14 21% 88% 0.209 0.8180.49 0.2 - -20100%1
3SL4_EDO_D_10 21% 80% 0.165 0.7690.52 0.33 - -30100%1
3SL4_EDO_A_15 20% 81% 0.213 0.8170.52 0.31 - -00100%1
3SL4_EDO_A_19 20% 88% 0.257 0.8610.5 0.19 - -10100%1
3SL4_EDO_A_441 19% 80% 0.282 0.8780.53 0.32 - -00100%1
3SL4_EDO_D_14 18% 84% 0.225 0.810.53 0.25 - -10100%1
3SL4_EDO_D_18 16% 84% 0.243 0.8150.49 0.27 - -20100%1
3SL4_EDO_A_21 16% 79% 0.354 0.9280.46 0.4 - -40100%1
3SL4_EDO_D_21 16% 91% 0.334 0.9030.52 0.08 - -50100%1
3SL4_EDO_D_20 14% 86% 0.255 0.8030.62 0.12 - -20100%1
3SL4_EDO_D_22 13% 88% 0.343 0.890.53 0.16 - -10100%1
3SL4_EDO_A_443 13% 91% 0.222 0.7630.46 0.13 - -80100%1
3SL4_EDO_A_9 13% 82% 0.268 0.8040.56 0.24 - -10100%1
3SL4_EDO_A_16 12% 75% 0.262 0.7940.42 0.57 - -00100%1
3SL4_EDO_C_15 12% 81% 0.268 0.7980.46 0.36 - -00100%1
3SL4_EDO_B_15 10% 90% 0.373 0.8860.55 0.06 - -70100%1
3SL4_EDO_D_6 10% 80% 0.298 0.7980.54 0.31 - -00100%1
3SL4_EDO_B_19 8% 79% 0.444 0.9150.42 0.44 - -00100%1
3SL4_EDO_C_13 4% 86% 0.371 0.7380.53 0.21 - -30100%1
6FET_EDO_D_512 95% 92% 0.074 0.980.33 0.22 - -00100%1
6FE7_EDO_D_512 93% 87% 0.074 0.970.47 0.23 - -00100%1
7AAG_EDO_B_510 88% 91% 0.088 0.9650.26 0.31 - -00100%1
1Y2D_EDO_B_721 88% 83% 0.098 0.9730.3 0.48 - -00100%1
3SL3_EDO_A_17 87% 78% 0.07 0.9410.49 0.4 - -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