Q01: 2-({[4-(4-tert-butylphenyl)piperazin-1-yl]sulfonyl}amino)-5-{[3-oxo-3-(phenylamino)propyl]sulfanyl}benzoic acid
Q01 is a Ligand Of Interest in 6U67 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 |
6U67_Q01_A_402 | 59% | 56% | 0.076 | 0.977 | 0.52 | 1.16 | - | 1 | 4 | 0 | 34% | 0.3415 |
6U67_Q01_B_401 | 58% | 54% | 0.142 | 0.92 | 0.75 | 1.04 | 2 | 5 | 0 | 0 | 100% | 1 |
6U67_Q01_B_402 | 55% | 60% | 0.089 | 0.969 | 0.48 | 1.04 | - | 1 | 3 | 0 | 37% | 0.3659 |
6U67_Q01_A_401 | 37% | 56% | 0.192 | 0.888 | 0.73 | 0.95 | 3 | 4 | 0 | 0 | 100% | 1 |
6U67_Q01_B_403 | 32% | 57% | 0.148 | 0.866 | 0.93 | 0.72 | 2 | 2 | 0 | 0 | 76% | 0.7561 |
6U67_Q01_A_403 | 17% | 76% | 0.156 | 0.83 | 0.4 | 0.55 | - | - | 0 | 0 | 46% | 0.4634 |