N0T: (1~{S},2~{S},3~{S},4~{R},5~{R})-4-(hydroxymethyl)-5-(octylamino)cyclopentane-1,2,3-triol
N0T is a Ligand Of Interest in 6TBF designated by the Author
| Best-fitted instance in this entry |
| Other instances in this entry |
Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
6TBF_N0T_A_602 | 94% | 37% | 0.069 | 0.969 | 1.23 | 1.25 | 1 | 1 | 0 | 0 | 100% | 0.9579 |
6TBF_N0T_B_602 | 94% | 32% | 0.073 | 0.97 | 1.34 | 1.37 | 2 | 3 | 0 | 0 | 100% | 1 |
6TBF_N0T_F_604 | 91% | 30% | 0.085 | 0.973 | 1.35 | 1.42 | 3 | 4 | 0 | 0 | 100% | 0.9368 |
6TBF_N0T_H_602 | 90% | 36% | 0.078 | 0.961 | 1.28 | 1.23 | 1 | 3 | 0 | 0 | 100% | 0.9211 |
6TBF_N0T_D_605 | 90% | 36% | 0.079 | 0.961 | 1 | 1.52 | 1 | 5 | 0 | 0 | 100% | 1 |
6TBF_N0T_G_603 | 90% | 21% | 0.085 | 0.966 | 1.67 | 1.61 | 3 | 6 | 0 | 0 | 100% | 0.9211 |
6TBF_N0T_E_604 | 89% | 34% | 0.089 | 0.969 | 1.35 | 1.27 | 2 | 2 | 0 | 0 | 100% | 0.8842 |
6TBF_N0T_C_603 | 80% | 26% | 0.09 | 0.938 | 1.22 | 1.77 | 3 | 5 | 0 | 0 | 100% | 0.8789 |