W31: (1S)-1-phenylethyl (4-chloro-3-{[(4S)-4-(2,6-dichlorophenyl)-2-hydroxy-6-oxocyclohex-1-en-1-yl]sulfanyl}phenyl)acetate
W31 is a Ligand Of Interest in 4R68 designated by the RCSB
| 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 |
|---|
| 4R68_W31_B_803 | 92% | 42% | 0.086 | 0.976 | 0.72 | 1.57 | - | 9 | 1 | 0 | 100% | 1 |
| 4R68_W31_D_802 | 92% | 48% | 0.085 | 0.974 | 0.64 | 1.35 | - | 6 | 0 | 0 | 100% | 1 |
| 4R68_W31_C_803 | 90% | 47% | 0.09 | 0.973 | 0.58 | 1.49 | - | 9 | 1 | 0 | 100% | 1 |
| 4R68_W31_A_803 | 87% | 43% | 0.095 | 0.966 | 0.59 | 1.62 | - | 9 | 0 | 0 | 100% | 1 |
