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
6W1D_EDO_D_201 73% 69% 0.12 0.9480.53 0.68 - -30100%0.72
6W1D_EDO_A_514 58% 48% 0.162 0.9411.32 0.69 - -70100%0.69
6W1D_EDO_A_507 58% 23% 0.193 0.9721.73 1.46 1 170100%0.58
6W1D_EDO_A_513 55% 72% 0.17 0.9390.51 0.56 - -10100%0.84
6W1D_EDO_B_102 53% 65% 0.113 0.8740.5 0.83 - -00100%1
6W1D_EDO_A_509 51% 46% 0.171 0.9250.74 1.33 - -00100%0.72
6W1D_EDO_A_523 47% 84% 0.173 0.9140.49 0.27 - -10100%0.7
6W1D_EDO_A_506 47% 90% 0.166 0.9050.43 0.19 - -10100%0.82
6W1D_EDO_B_101 45% 70% 0.21 0.9410.82 0.35 - -20100%0.71
6W1D_EDO_A_545 44% 86% 0.148 0.8750.45 0.28 - -00100%1
6W1D_EDO_A_510 42% 77% 0.155 0.8750.45 0.47 - -10100%1
6W1D_EDO_A_516 42% 81% 0.201 0.9210.47 0.36 - -10100%0.47
6W1D_EDO_B_111 42% 88% 0.129 0.8460.5 0.19 - -00100%1
6W1D_EDO_C_303 35% 87% 0.235 0.9230.45 0.24 - -00100%0.77
6W1D_EDO_D_206 33% 76% 0.14 0.8180.43 0.53 - -00100%1
6W1D_EDO_A_552 33% 67% 0.224 0.9040.54 0.71 - -30100%1
6W1D_EDO_A_512 33% 69% 0.209 0.8870.42 0.75 - -00100%0.71
6W1D_EDO_A_508 32% 91% 0.19 0.8650.5 0.1 - -00100%1
6W1D_EDO_D_205 32% 73% 0.204 0.8790.5 0.55 - -00100%0.75
6W1D_EDO_A_546 32% 51% 0.193 0.8640.83 1.05 - -00100%0.88
6W1D_EDO_A_511 29% 68% 0.203 0.8620.5 0.73 - -20100%0.76
6W1D_EDO_A_522 24% 58% 0.293 0.9250.79 0.83 - -10100%0.68
6W1D_EDO_A_524 20% 79% 0.245 0.8510.44 0.42 - -00100%0.84
6W1D_EDO_B_105 20% 82% 0.2 0.8030.45 0.35 - -00100%1
6W1D_EDO_A_537 19% 91% 0.254 0.8470.44 0.14 - -10100%1
6W1D_EDO_A_541 17% 78% 0.272 0.8520.51 0.39 - -00100%0.98
6W1D_EDO_A_536 17% 58% 0.224 0.8020.53 1.07 - -00100%0.71
6W1D_EDO_B_107 15% 83% 0.172 0.7270.52 0.27 - -00100%1
6W1D_EDO_A_525 13% 89% 0.217 0.7570.47 0.19 - -00100%0.91
6W1D_EDO_A_538 13% 73% 0.249 0.7890.56 0.48 - -10100%1
6W1D_EDO_A_539 12% 87% 0.174 0.6990.47 0.23 - -00100%0.93
6W1D_EDO_B_110 11% 92% 0.204 0.7220.53 0.02 - -10100%1
6W1D_EDO_A_515 11% 80% 0.202 0.7130.59 0.26 - -20100%1
6W1D_EDO_A_547 10% 69% 0.274 0.780.47 0.73 - -10100%1
6W1D_EDO_B_103 10% 88% 0.22 0.7170.43 0.24 - -10100%0.98
6W1D_EDO_A_517 8% 87% 0.365 0.8490.28 0.4 - -30100%0.63
6W1D_EDO_A_542 8% 83% 0.335 0.8020.48 0.3 - -00100%0.9
6W1D_EDO_A_540 7% 79% 0.209 0.6530.47 0.4 - -00100%1
6W1D_EDO_C_304 6% 93% 0.448 0.8970.37 0.14 - -30100%0.67
6W1D_EDO_A_530 5% 78% 0.383 0.8050.43 0.47 - -10100%0.71
6W1D_EDO_A_554 4% 92% 0.303 0.680.49 0.03 - -40100%1
6W1D_EDO_B_109 3% 88% 0.27 0.6240.43 0.24 - -10100%1
6W1D_EDO_A_535 3% 74% 0.45 0.7820.42 0.58 - -30100%0.63
6W1D_EDO_D_203 2% 88% 0.326 0.6250.52 0.16 - -00100%0.95
6W1D_EDO_A_528 2% 62% 0.437 0.710.77 0.7 - -00100%0.69
6W1D_EDO_A_553 2% 85% 0.366 0.6170.39 0.36 - -20100%1
6W1D_EDO_C_306 2% 88% 0.266 0.512 0.47 0.2 - -00100%1
6W1D_EDO_A_529 1% 85% 0.459 0.6050.49 0.25 - -00100%1
8TVT_EDO_A_508 77% 47% 0.117 0.9580.68 1.33 - -40100%0.64
6WI2_EDO_A_515 70% 79% 0.123 0.9410.49 0.37 - -00100%1
6WIH_EDO_B_403 65% 52% 0.149 0.9520.75 1.08 - -10100%0.8
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