Table 4. Structure solution and refinement.
Values in parentheses are for the outer shell.
| PDB entry | 6ubl |
| Resolution range (Å) | 34.7–1.50 (1.52–1.50) |
| Completeness (%) | 97.3 |
| No. of reflections, working set | 70715 (2000) |
| No. of reflections, test set | 3518 (117) |
| Final R work | 0.161 (0.405) |
| Final R free | 0.185 (0.362) |
| No. of non-H atoms | |
| Protein | 3287 |
| Ligand | 3 |
| Solvent | 422 |
| Total | 374 |
| Ligand RSC | |
| Palmitic acid A | 0.94 |
| Palmitic acid B | 0.91 |
| R.m.s. deviations | |
| Bonds (Å) | 0.007 |
| Angles (°) | 1.0 |
| Average B factors (Å2) | 32 |
| Protein | 31 |
| Ligand | 46 |
| Water | 41 |
| Ramachandran plot | |
| Most favored (%) | 99.3 |
| Allowed outliers (%) | 0.0 |