D4O: (3~{S})-3-[[(1~{S},3~{S})-3-methylcyclohexyl]methyl]-6,8-bis(oxidanyl)-3,4-dihydroisochromen-1-one
D4O is a Ligand Of Interest in 6KA6 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 |
6KA6_D4O_A_601 | 76% | 22% | 0.121 | 0.958 | 1.61 | 1.66 | 1 | 5 | 0 | 0 | 100% | 1 |
6KA6_D4O_B_601 | 70% | 21% | 0.124 | 0.943 | 1.62 | 1.7 | 1 | 5 | 1 | 0 | 100% | 1 |
6KA6_D4O_D_601 | 70% | 27% | 0.13 | 0.949 | 1.58 | 1.38 | 1 | 4 | 0 | 0 | 100% | 1 |
6KA6_D4O_C_601 | 65% | 25% | 0.157 | 0.96 | 1.52 | 1.55 | 1 | 4 | 0 | 0 | 100% | 1 |