5AUQ
Crystal structure of ATPase-type HypB in the nucleotide free state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-06-22 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.1000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 120.294, 77.901, 122.928 |
| Unit cell angles | 90.00, 104.96, 90.00 |
Refinement procedure
| Resolution | 40.601 - 2.525 |
| R-factor | 0.2159 |
| Rwork | 0.214 |
| R-free | 0.24580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vx3 |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.544 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.550 |
| High resolution limit [Å] | 2.510 | 2.510 |
| Rmerge | 0.073 | 0.593 |
| Number of reflections | 73757 | |
| <I/σ(I)> | 15.5 | 2 |
| Completeness [%] | 99.8 | 99.5 |
| Redundancy | 3.2 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | Magnesium chloride, PEG 3350 |
