444: N-(2,2,2-TRIFLUOROETHYL)-N-{4-[2,2,2-TRIFLUORO-1-HYDROXY-1-(TRIFLUOROMETHYL)ETHYL]PHENYL}BENZENESULFONAMIDE
444 is a Ligand Of Interest in 5K3L designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with same target (top 5) |
| Best-fitted instance in this entry |
| Best-fitted PDB instances with different target (top 5) |
| 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 |
|---|
| 5K3L_444_C_900 | 5% | 2% | 0.496 | 0.914 | 4.07 | 2.73 | 2 | 17 | 1 | 0 | 100% | 1 |
| 5K3L_444_A_900 | 2% | 2% | 0.566 | 0.847 | 4.04 | 3.09 | 4 | 20 | 1 | 0 | 100% | 1 |
| 5K3L_444_D_900 | 1% | 2% | 0.689 | 0.846 | 4.04 | 2.66 | 2 | 14 | 3 | 0 | 100% | 1 |
| 5K3L_444_B_900 | 0% | 2% | 0.784 | 0.806 | 3.96 | 2.67 | 2 | 12 | 3 | 0 | 100% | 1 |
| 4NB6_444_B_501 | 47% | 32% | 0.203 | 0.944 | 1.33 | 1.36 | 3 | 5 | 0 | 0 | 100% | 0.8226 |
| 5NTQ_444_A_501 | 43% | 32% | 0.156 | 0.88 | 1.23 | 1.48 | 4 | 9 | 0 | 0 | 100% | 1 |
| 5EJV_444_B_601 | 20% | 0% | 0.252 | 0.857 | 6.66 | 2.67 | 16 | 15 | 2 | 0 | 100% | 1 |
| 2O9I_444_A_2 | 9% | 0% | 0.346 | 0.837 | 6.17 | 3.35 | 20 | 13 | 3 | 0 | 100% | 1 |
