2ED4
Crystal structure of flavin reductase HpaC complexed with FAD and NAD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL45XU |
| Synchrotron site | SPring-8 |
| Beamline | BL45XU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2002-10-21 |
| Detector | RIGAKU RAXIS V |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.746, 43.655, 74.788 |
| Unit cell angles | 90.00, 93.70, 90.00 |
Refinement procedure
| Resolution | 41.660 - 1.850 |
| Rwork | 0.177 |
| R-free | 0.21300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | FAD containing form of HpaC |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.800 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.660 | 1.920 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.076 | 0.250 |
| Number of reflections | 22966 | |
| <I/σ(I)> | 15.2 | 7.4 |
| Completeness [%] | 99.7 | 99.3 |
| Redundancy | 3.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 1000, 10% PEG 8000, 10% glycerol, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
