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
6FE7_EDO_D_512 93% 87% 0.074 0.970.47 0.23 - -00100%1
6FE7_EDO_D_505 83% 76% 0.094 0.9530.49 0.45 - -00100%1
6FE7_EDO_B_506 70% 51% 0.121 0.9380.37 1.48 - 100100%1
6FE7_EDO_A_506 70% 55% 0.113 0.9290.71 1.03 - -00100%1
6FE7_EDO_D_516 68% 53% 0.14 0.9510.51 1.29 - -00100%1
6FE7_EDO_D_504 65% 75% 0.128 0.930.77 0.21 - -00100%1
6FE7_EDO_A_507 65% 53% 0.152 0.9540.29 1.5 - -00100%1
6FE7_EDO_C_517 64% 74% 0.107 0.9050.32 0.69 - -00100%1
6FE7_EDO_D_507 64% 77% 0.156 0.9550.46 0.46 - -00100%1
6FE7_EDO_D_514 63% 58% 0.131 0.9271.04 0.58 - -00100%1
6FE7_EDO_B_503 62% 57% 0.135 0.9270.43 1.19 - -00100%1
6FE7_EDO_D_501 60% 71% 0.128 0.9140.76 0.36 - -00100%1
6FE7_EDO_A_514 59% 66% 0.133 0.9140.53 0.78 - -00100%1
6FE7_EDO_C_511 54% 68% 0.141 0.9070.61 0.64 - -00100%1
6FE7_EDO_A_521 53% 67% 0.138 0.8970.52 0.76 - -10100%1
6FE7_EDO_A_505 50% 84% 0.179 0.9310.51 0.25 - -00100%1
6FE7_EDO_B_512 49% 68% 0.156 0.9010.09 1.11 - -00100%1
6FE7_EDO_C_504 48% 90% 0.174 0.9190.44 0.16 - -00100%1
6FE7_EDO_C_507 47% 80% 0.191 0.9310.43 0.41 - -00100%1
6FE7_EDO_C_508 46% 72% 0.16 0.8950.47 0.62 - -00100%1
6FE7_EDO_A_513 45% 53% 0.214 0.9480.27 1.5 - 100100%1
6FE7_EDO_C_522 43% 77% 0.215 0.9380.45 0.47 - -00100%1
6FE7_EDO_B_520 42% 72% 0.191 0.9090.42 0.64 - -00100%1
6FE7_EDO_C_518 38% 75% 0.18 0.8810.29 0.69 - -00100%1
6FE7_EDO_C_516 37% 51% 0.159 0.8571.03 0.88 - -00100%1
6FE7_EDO_B_515 36% 78% 0.2 0.8950.36 0.53 - -00100%1
6FE7_EDO_B_507 35% 52% 0.218 0.9080.29 1.55 - -00100%1
6FE7_EDO_A_512 32% 59% 0.263 0.9380.31 1.23 - -00100%1
6FE7_EDO_C_509 31% 85% 0.248 0.920.3 0.43 - -10100%1
6FE7_EDO_D_520 31% 68% 0.2 0.870.32 0.9 - -00100%1
6FE7_EDO_A_523 31% 64% 0.232 0.8990.5 0.88 - -00100%1
6FE7_EDO_A_503 30% 71% 0.226 0.8880.36 0.73 - -00100%1
6FE7_EDO_C_510 27% 71% 0.226 0.8740.18 0.92 - -00100%1
6FE7_EDO_A_504 27% 65% 0.265 0.9130.4 0.92 - -00100%1
6FE7_EDO_D_521 26% 61% 0.242 0.8850.61 0.88 - -30100%1
6FE7_EDO_B_519 24% 63% 0.279 0.9110.29 1.12 - -00100%1
6FE7_EDO_A_515 24% 59% 0.284 0.9151.18 0.43 - -00100%1
6FE7_EDO_C_515 21% 69% 0.254 0.8640.86 0.34 - -20100%1
6FE7_EDO_D_515 21% 53% 0.251 0.860.46 1.32 - -00100%1
6FE7_EDO_B_511 21% 51% 0.272 0.8810.69 1.2 - -00100%1
6FE7_EDO_B_505 18% 75% 0.228 0.8160.45 0.52 - -00100%1
6FE7_EDO_D_513 18% 49% 0.235 0.8180.79 1.16 - -10100%1
6FE7_EDO_D_511 17% 65% 0.353 0.9380.47 0.86 - -00100%1
6FE7_EDO_D_522 17% 6% 0.21 0.7852.63 2.36 3 200100%1
6FE7_EDO_A_509 16% 78% 0.225 0.7930.54 0.37 - -00100%1
6FE7_EDO_D_506 15% 61% 0.238 0.80.32 1.15 - -00100%1
6FE7_EDO_B_514 13% 73% 0.215 0.7590.77 0.29 - -00100%1
6FE7_EDO_B_504 13% 78% 0.297 0.8360.27 0.62 - -10100%1
6FE7_EDO_A_508 13% 81% 0.312 0.850.44 0.38 - -10100%1
6FE7_EDO_B_518 10% 72% 0.347 0.8580.83 0.28 - -00100%1
6FE7_EDO_B_517 7% 58% 0.367 0.8250.19 1.37 - -00100%1
6FE7_EDO_A_522 5% 73% 0.474 0.8990.58 0.47 - -00100%1
6FE7_EDO_C_501 4% 86% 0.485 0.8520.54 0.19 - -00100%1
6FE7_EDO_A_525 3% 79% 0.355 0.6870.77 0.11 - -20100%1
6FE7_EDO_B_513 3% 67% 0.553 0.8750.58 0.68 - -00100%1
6FE7_EDO_B_510 1% 65% 0.618 0.8430.48 0.87 - -00100%1
6FE7_EDO_C_512 0% 57% 0.581 0.6260.96 0.69 - -00100%1
6FE7_EDO_C_503 0% 78% 0.827 0.8330.42 0.47 - -00100%1
6FET_EDO_D_512 95% 92% 0.074 0.980.33 0.22 - -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
6FW3_EDO_D_510 86% 56% 0.089 0.9570.33 1.34 - -00100%1
6ANS_EDO_A_404 100% 89% 0.029 0.9950.57 0.07 - -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
3G7R_EDO_B_961 100% 85% 0.035 0.9880.45 0.3 - -10100%1