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
6FW3_EDO_D_510 86% 56% 0.089 0.9570.33 1.34 - -00100%1
6FW3_EDO_D_514 84% 84% 0.102 0.9650.26 0.5 - -10100%1
6FW3_EDO_D_505 84% 63% 0.088 0.950.76 0.65 - -00100%1
6FW3_EDO_B_506 80% 64% 0.094 0.9440.44 0.91 - -00100%1
6FW3_EDO_D_512 79% 74% 0.1 0.9460.28 0.71 - -00100%1
6FW3_EDO_A_517 76% 72% 0.106 0.9410.26 0.8 - -00100%1
6FW3_EDO_C_502 67% 91% 0.102 0.910.53 0.06 - -00100%1
6FW3_EDO_A_507 63% 78% 0.135 0.930.36 0.52 - -00100%1
6FW3_EDO_A_512 62% 87% 0.143 0.9350.3 0.4 - -00100%1
6FW3_EDO_D_508 59% 78% 0.144 0.9260.28 0.61 - -00100%1
6FW3_EDO_D_513 54% 68% 0.116 0.880.47 0.76 - -00100%1
6FW3_EDO_A_515 53% 66% 0.142 0.9030.19 1.08 - -00100%1
6FW3_EDO_A_504 53% 91% 0.154 0.9140.26 0.3 - -30100%1
6FW3_EDO_A_519 52% 88% 0.108 0.8650.35 0.31 - -00100%1
6FW3_EDO_C_505 49% 92% 0.153 0.90.39 0.16 - -00100%1
6FW3_EDO_A_509 49% 65% 0.158 0.9030.32 0.99 - -00100%1
6FW3_EDO_C_507 48% 88% 0.138 0.8790.24 0.43 - -00100%1
6FW3_EDO_B_503 47% 60% 0.122 0.8610.46 1.04 - -00100%1
6FW3_EDO_D_511 46% 67% 0.16 0.8950.48 0.77 - -00100%1
6FW3_EDO_D_502 46% 71% 0.135 0.8680.75 0.38 - -00100%1
6FW3_EDO_B_515 46% 84% 0.153 0.8860.43 0.33 - -20100%1
6FW3_EDO_B_510 43% 70% 0.173 0.8960.24 0.91 - -00100%1
6FW3_EDO_D_501 41% 56% 0.167 0.880.29 1.37 - -00100%1
6FW3_EDO_C_509 39% 81% 0.141 0.8460.3 0.51 - -00100%1
6FW3_EDO_A_508 36% 62% 0.154 0.8450.6 0.85 - -00100%1
6FW3_EDO_B_504 36% 76% 0.196 0.8880.78 0.18 - -00100%1
6FW3_EDO_A_518 35% 80% 0.206 0.8970.42 0.42 - -00100%1
6FW3_EDO_A_516 34% 84% 0.197 0.8820.41 0.35 - -00100%1
6FW3_EDO_B_509 31% 72% 0.144 0.8110.42 0.67 - -00100%1
6FW3_EDO_C_506 31% 73% 0.173 0.8380.18 0.84 - -00100%1
6FW3_EDO_B_516 30% 74% 0.175 0.8350.24 0.77 - -00100%1
6FW3_EDO_D_507 29% 59% 0.152 0.8110.63 0.92 - -00100%1
6FW3_EDO_B_508 29% 77% 0.231 0.8920.51 0.4 - -00100%1
6FW3_EDO_A_514 28% 87% 0.204 0.8590.45 0.26 - -00100%1
6FW3_EDO_C_517 28% 86% 0.205 0.8590.44 0.29 - -00100%1
6FW3_EDO_A_513 27% 71% 0.215 0.860.35 0.76 - -00100%1
6FW3_EDO_A_510 26% 85% 0.255 0.8990.53 0.23 - -00100%1
6FW3_EDO_D_515 23% 77% 0.182 0.8050.28 0.64 - -00100%1
6FW3_EDO_D_517 19% 94% 0.183 0.7730.24 0.22 - -00100%1
6FW3_EDO_C_512 18% 80% 0.24 0.8280.4 0.44 - -00100%1
6FW3_EDO_A_522 18% 63% 0.234 0.8170.45 0.96 - -00100%1
6FW3_EDO_A_524 15% 69% 0.193 0.7540.38 0.82 - -00100%1
6FW3_EDO_C_513 15% 78% 0.189 0.7480.24 0.63 - -00100%1
6FW3_EDO_A_506 15% 88% 0.275 0.8330.23 0.43 - -10100%1
6FW3_EDO_A_520 13% 92% 0.189 0.7290.52 0.03 - -00100%1
6FW3_EDO_A_503 13% 71% 0.188 0.7250.32 0.77 - -00100%1
6FW3_EDO_B_511 12% 73% 0.18 0.7050.61 0.45 - -00100%1
6FW3_EDO_C_501 11% 75% 0.293 0.8150.52 0.47 - -00100%1
6FW3_EDO_D_506 11% 75% 0.268 0.7890.48 0.49 - -00100%1
6FW3_EDO_C_508 11% 79% 0.252 0.7670.18 0.68 - -00100%1
6FW3_EDO_C_515 9% 88% 0.298 0.7960.4 0.28 - -10100%1
6FW3_EDO_B_514 8% 78% 0.227 0.690.67 0.23 - -00100%1
6FW3_EDO_B_513 7% 64% 0.303 0.7680.89 0.49 - -00100%1
6FW3_EDO_C_510 7% 79% 0.236 0.6830.24 0.62 - -00100%1
6FW3_EDO_C_516 6% 83% 0.276 0.7160.29 0.49 - -00100%1
6FW3_EDO_B_505 2% 76% 0.293 0.580.64 0.32 - -00100%1
6FW3_EDO_C_514 2% 52% 0.297 0.529 0.54 1.3 - -00100%1
6FW3_EDO_A_525 0% 85% 0.431 0.407 0.38 0.37 - -20100%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
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