HTO: HEPTANE-1,2,3-TRIOL



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
3G7F_HTO_H_705 67% 67% 0.131 0.940.41 0.84 - -10100%1
3G7F_HTO_C_706 29% 73% 0.212 0.870.43 0.61 - -10100%1
3G7F_HTO_C_707 24% 55% 0.222 0.8520.77 0.97 - -10100%1
3G7F_HTO_L_708 0% 74% 1.899 0.222 0.22 0.78 - -00100%1
3G7F_HTO_L_709 0% 75% 1.789 -0.185 0.22 0.74 - -00100%1
6ZIA_HTO_H_710 53% 51% 0.138 0.8990.85 1.04 - 100100%1
5O64_HTO_H_308 44% 46% 0.157 0.8850.83 1.26 - 200100%1
3T6D_HTO_H_272 43% 38% 0.169 0.8940.74 1.68 - 310100%0.75
6ZID_HTO_H_710 40% 51% 0.157 0.8650.85 1.04 - 100100%1
6ZI6_HTO_H_710 36% 51% 0.17 0.860.85 1.04 - 100100%1
2HPY_HTO_B_1401 79% 28% 0.103 0.951.81 1.1 2 110100%1
5IU8_HTO_A_2402 59% 12% 0.141 0.9220.51 3.53 - 300100%1
3DTU_HTO_B_1 59% 73% 0.153 0.9340.21 0.82 - -11100%1
4TSY_HTO_A_209 57% 40% 0.161 0.9370.59 1.71 - 300100%1