A1I9A: 2-[(3-carboxy-4-nitro-phenyl)disulfanyl]ethyl-trimethyl-azanium
A1I9A is a Ligand Of Interest in 9QPU 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 |
| 9QPU_A1I9A_A_603 | 52% | 22% | 0.138 | 0.896 | 1.89 | 1.35 | 4 | 3 | 1 | 0 | 100% | 1 |
| 9QPU_A1I9A_A_607 | 12% | 20% | 0.199 | 0.722 | 1.77 | 1.59 | 4 | 4 | 0 | 0 | 100% | 1 |