398: N,N-dibutyl-4-chloranyl-1-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-[(7-iodanylnaphthalen-2-yl)sulfonylcarbamoyl]phenyl]-5-methyl-pyrazole-3-carboxamide
398 is a Ligand Of Interest in 4AQ3 designated by the RCSB
| 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 |
|---|
| 4AQ3_398_D_1163 | 72% | 9% | 0.163 | 0.989 | 2.38 | 2.2 | 9 | 14 | 1 | 0 | 100% | 1 |
| 4AQ3_398_E_1163 | 71% | 10% | 0.165 | 0.988 | 1.96 | 2.53 | 7 | 23 | 1 | 0 | 100% | 1 |
| 4AQ3_398_B_1163 | 71% | 10% | 0.164 | 0.986 | 2.23 | 2.24 | 8 | 16 | 1 | 0 | 100% | 1 |
| 4AQ3_398_F_1163 | 70% | 11% | 0.168 | 0.987 | 2.1 | 2.28 | 10 | 20 | 2 | 0 | 100% | 1 |
| 4AQ3_398_C_1163 | 69% | 9% | 0.171 | 0.989 | 2.24 | 2.38 | 7 | 20 | 1 | 0 | 100% | 1 |
| 4AQ3_398_A_1163 | 67% | 9% | 0.178 | 0.987 | 2.14 | 2.49 | 7 | 19 | 3 | 0 | 100% | 1 |
