A1L46: (1~{S},3~{S})-1-(3-hydroxy-3-oxopropyl)-2,3,4,9-tetrahydropyrido[3,4-b]indole-1,3-dicarboxylic acid
A1L46 is a Ligand Of Interest in 9NST 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 |
9NST_A1L46_A_401 | 100% | 31% | 0.024 | 0.997 | 1.65 | 1.11 | 2 | - | 3 | 0 | 100% | 1 |
9NST_A1L46_B_401 | 100% | 29% | 0.023 | 0.997 | 1.78 | 1.09 | 3 | - | 1 | 0 | 100% | 1 |
9NST_A1L46_D_401 | 100% | 30% | 0.025 | 0.996 | 1.71 | 1.09 | 3 | - | 3 | 0 | 100% | 1 |
9NST_A1L46_C_401 | 100% | 30% | 0.029 | 0.996 | 1.75 | 1.06 | 1 | - | 1 | 0 | 100% | 1 |