6OBV
Structural insights into dehydratase substrate selection for the borrelidin and fluvirucin polyketide synthases
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 2017-06-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 152.760, 38.780, 196.970 |
| Unit cell angles | 90.00, 103.98, 90.00 |
Refinement procedure
| Resolution | 19.820 - 2.010 |
| R-factor | 0.1982 |
| Rwork | 0.197 |
| R-free | 0.26320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.902 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.15rc3_3435) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.100 | 2.040 |
| High resolution limit [Å] | 2.010 | 2.010 |
| Number of reflections | 75387 | 3800 |
| <I/σ(I)> | 12.9 | |
| Completeness [%] | 89.2 | |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | 300 | 0.40 M NaCl, 0.10 M Tris pH 8.5, and 29% (w/v) PEG 3350 |
