3T6D
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) |
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
3T6D_HTO_H_272 | 43% | 38% | 0.169 | 0.894 | 0.74 | 1.68 | - | 3 | 1 | 0 | 100% | 0.75 |
3T6D_HTO_L_277 | 27% | 53% | 0.17 | 0.815 | 0.45 | 1.35 | - | 1 | 2 | 0 | 100% | 0.55 |
3T6D_HTO_L_278 | 18% | 40% | 0.203 | 0.786 | 0.67 | 1.63 | - | 3 | 0 | 0 | 100% | 0.55 |
3T6D_HTO_C_356 | 13% | 33% | 0.272 | 0.817 | 0.75 | 1.85 | - | 3 | 0 | 0 | 100% | 0.6 |
3T6D_HTO_C_355 | 11% | 43% | 0.241 | 0.752 | 0.55 | 1.61 | - | 2 | 6 | 0 | 100% | 0.75 |
3T6D_HTO_H_273 | 6% | 57% | 0.338 | 0.763 | 0.44 | 1.21 | - | 1 | 2 | 0 | 100% | 0.5 |
3T6D_HTO_L_276 | 4% | 47% | 0.481 | 0.852 | 0.47 | 1.55 | - | 2 | 0 | 0 | 100% | 0.65 |
3T6D_HTO_C_358 | 3% | 19% | 0.305 | 0.656 | 0.73 | 2.66 | - | 4 | 0 | 0 | 100% | 0.45 |
3T6D_HTO_L_279 | 2% | 51% | 0.322 | 0.598 | 0.39 | 1.46 | - | 1 | 1 | 0 | 100% | 0.5 |
3T6D_HTO_L_280 | 1% | 61% | 0.39 | 0.47 | 0.43 | 1.04 | - | 1 | 0 | 0 | 100% | 0.45 |
3T6D_HTO_M_333 | 0% | 23% | 0.717 | 0.781 | 0.48 | 2.65 | - | 4 | 0 | 0 | 100% | 0.5 |
3T6D_HTO_C_357 | 0% | 65% | 0.614 | 0.648 | 0.58 | 0.76 | - | - | 2 | 0 | 100% | 0.55 |
3T6D_HTO_H_274 | 0% | 72% | 0.57 | 0.536 | 0.32 | 0.75 | - | - | 1 | 0 | 100% | 0.4 |
3G7F_HTO_H_705 | 75% | 66% | 0.1 | 0.933 | 0.42 | 0.87 | - | - | 1 | 0 | 100% | 1 |
6ZIA_HTO_H_710 | 53% | 51% | 0.138 | 0.899 | 0.85 | 1.04 | - | 1 | 0 | 0 | 100% | 1 |
5O64_HTO_H_308 | 44% | 46% | 0.157 | 0.885 | 0.83 | 1.26 | - | 2 | 0 | 0 | 100% | 1 |
6ZID_HTO_H_710 | 40% | 51% | 0.157 | 0.865 | 0.85 | 1.04 | - | 1 | 0 | 0 | 100% | 1 |
6ZI6_HTO_H_710 | 36% | 51% | 0.17 | 0.86 | 0.85 | 1.04 | - | 1 | 0 | 0 | 100% | 1 |
2HPY_HTO_B_1401 | 79% | 28% | 0.103 | 0.95 | 1.81 | 1.1 | 2 | 1 | 1 | 0 | 100% | 1 |
5IU8_HTO_A_2402 | 59% | 12% | 0.141 | 0.922 | 0.51 | 3.53 | - | 3 | 0 | 0 | 100% | 1 |
3DTU_HTO_B_1 | 59% | 73% | 0.153 | 0.934 | 0.21 | 0.82 | - | - | 1 | 1 | 100% | 1 |
4TSY_HTO_A_209 | 57% | 40% | 0.161 | 0.937 | 0.59 | 1.71 | - | 3 | 0 | 0 | 100% | 1 |