4WAM
H. influenzae beta-carbonic anhydrase variant W39V/G41A/P48S/A49P
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2010-05-28 |
Detector | OXFORD RUBY CCD |
Wavelength(s) | 1.54 |
Spacegroup name | I 21 21 21 |
Unit cell lengths | 48.162, 130.259, 143.868 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 96.560 - 2.200 |
R-factor | 0.23508 |
Rwork | 0.232 |
R-free | 0.28681 |
RMSD bond length | 0.016 |
RMSD bond angle | 1.793 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 96.560 | 2.260 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.521 | |
Number of reflections | 22403 | |
<I/σ(I)> | 7.2 | 1.7 |
Completeness [%] | 95.3 | 83.1 |
Redundancy | 3.3 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 295 | 0.30 M sodium potassium phosphate, 12 mg/mL protein |