3WD: 2-methyl-L-alanyl-N-[(3R,4S,5S)-3-methoxy-1-{(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino}propyl]pyrrolidin-1-yl}-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide
3WD is a Ligand Of Interest in 4X1I 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 |
|---|
| 4X1I_3WD_B_503 | 39% | 31% | 0.206 | 0.913 | 0.99 | 1.72 | 3 | 9 | 1 | 0 | 100% | 1 |
| 4X1I_3WD_D_503 | 16% | 40% | 0.305 | 0.88 | 1.03 | 1.32 | 4 | 9 | 0 | 0 | 100% | 1 |
