5AUP
Crystal structure of the HypAB complex
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 | 2014-02-14 |
Detector | DECTRIS PILATUS 2M-F |
Wavelength(s) | 1.1000 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 121.945, 123.931, 55.099 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.537 - 3.102 |
R-factor | 0.1969 |
Rwork | 0.195 |
R-free | 0.23850 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3A43 and 3VX3 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.527 |
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 | 3.210 |
High resolution limit [Å] | 3.100 | 3.100 |
Rmerge | 0.220 | |
Number of reflections | 31382 | |
<I/σ(I)> | 9 | 1.7 |
Completeness [%] | 99.7 | 99.4 |
Redundancy | 6.1 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | magnesium chloride, PEG 3350 |