6CXT
Crystal structure of FAD-dependent dehydrogenase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-11-07 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | P 64 2 2 |
| Unit cell lengths | 104.416, 104.416, 234.139 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.000 - 1.900 |
| R-factor | 0.1828 |
| Rwork | 0.182 |
| R-free | 0.21072 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB entries 4IRN & 4ETW |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.881 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.000 | 45.000 | 1.930 |
| High resolution limit [Å] | 1.900 | 5.150 | 1.900 |
| Rmerge | 0.100 | 0.043 | 0.645 |
| Rmeas | 0.102 | 0.044 | 0.660 |
| Rpim | 0.021 | 0.010 | 0.139 |
| Total number of observations | 1386667 | ||
| Number of reflections | 60078 | 3353 | 2932 |
| <I/σ(I)> | 7.7 | ||
| Completeness [%] | 100.0 | 99.8 | 100 |
| Redundancy | 23.1 | 21.6 | 22.2 |
| CC(1/2) | 0.999 | 0.971 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 279 | 15 mM magnesium acetate, 50 mM sodium cacodylate, pH 6.0, 1.8 M ammonium sulfate |
