MPD: (4S)-2-METHYL-2,4-PENTANEDIOL
| 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 |
2J40_MPD_B_1517 | 73% | 80% | 0.132 | 0.96 | 0.3 | 0.54 | - | - | 1 | 0 | 100% | 1 |
2J40_MPD_B_1522 | 58% | 57% | 0.147 | 0.926 | 0.51 | 1.11 | - | - | 1 | 0 | 100% | 1 |
2J40_MPD_B_1524 | 24% | 77% | 0.273 | 0.905 | 0.27 | 0.63 | - | - | 0 | 0 | 100% | 1 |
2J40_MPD_B_1523 | 15% | 91% | 0.217 | 0.776 | 0.25 | 0.32 | - | - | 0 | 0 | 100% | 1 |