5BUV
X-ray structure of WbcA from Yersinia enterocolitica
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-11-17 |
Detector | Bruker Platinum 135 |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 79.160, 42.678, 150.463 |
Unit cell angles | 90.00, 90.39, 90.00 |
Refinement procedure
Resolution | 27.360 - 1.750 |
R-factor | 0.19513 |
Rwork | 0.192 |
R-free | 0.24795 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4hn0 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.998 |
Data reduction software | SAINT |
Data scaling software | SADABS |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.800 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.341 | |
Number of reflections | 50180 | |
<I/σ(I)> | 6.9 | 2 |
Completeness [%] | 98.1 | 95 |
Redundancy | 2.5 | 1.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 14-18% PEG5000-OMe, 5 mM CPD-6-deoxygulose, 2% glycerol, 100 mM MOPS |