A1AU6: N-[(2S)-3-hydroxy-1-{[(4S)-1-hydroxy-2-(hydroxymethyl)-6-methyl-3-oxoheptan-4-yl]amino}-1-oxopropan-2-yl]butanamide
A1AU6 is a Ligand Of Interest in 9C98 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 |
9C98_A1AU6_Y_301 | 74% | 26% | 0.106 | 0.935 | 1.8 | 1.19 | 4 | 3 | 0 | 0 | 100% | 1 |
9C98_A1AU6_K_301 | 68% | 26% | 0.116 | 0.926 | 1.76 | 1.23 | 4 | 1 | 0 | 0 | 100% | 1 |
9C98_A1AU6_N_201 | 64% | 25% | 0.115 | 0.914 | 1.81 | 1.26 | 4 | 4 | 0 | 0 | 100% | 1 |
9C98_A1AU6_b_201 | 62% | 28% | 0.126 | 0.917 | 1.81 | 1.11 | 4 | 2 | 0 | 0 | 100% | 1 |
9C98_A1AU6_H_301 | 42% | 25% | 0.157 | 0.875 | 1.84 | 1.21 | 4 | 3 | 0 | 0 | 100% | 1 |
9C98_A1AU6_V_301 | 39% | 27% | 0.155 | 0.862 | 1.85 | 1.09 | 4 | 1 | 0 | 0 | 100% | 1 |