A1JKT: 2-[[2-[methyl-[2-(4-phenylphenyl)ethyl]amino]-1,3-thiazol-4-yl]methyl]-3,4-dihydro-1~{H}-isoquinoline-7-carboxylic acid
A1JKT is a Ligand Of Interest in 9S0O 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 |
| 9S0O_A1JKT_A_201 | 96% | 56% | 0.054 | 0.962 | 0.76 | 0.95 | 1 | 3 | 0 | 0 | 100% | 1 |
| 9S0O_A1JKT_B_202 | 81% | 64% | 0.088 | 0.941 | 0.64 | 0.75 | 1 | 1 | 1 | 0 | 100% | 1 |