7F2Z
Crystal structure of OxdB E85A mutant (form II)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-05-28 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.90000 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 62.662, 62.662, 359.273 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.920 - 2.300 |
R-factor | 0.184 |
Rwork | 0.182 |
R-free | 0.23800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3a15 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.941 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.919 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.077 | 0.827 |
Number of reflections | 37816 | 3621 |
<I/σ(I)> | 21.1 | 2.37 |
Completeness [%] | 99.8 | 98.4 |
Redundancy | 9.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.0 M sodium citrate and 0.1M sodium cacodylate pH6.5 |