5L2D
Streptococcal surface adhesin - CshA NR2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-09-15 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.920 |
Spacegroup name | P 62 2 2 |
Unit cell lengths | 173.929, 173.929, 104.071 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 61.010 - 2.660 |
R-factor | 0.20435 |
Rwork | 0.201 |
R-free | 0.26353 |
Structure solution method | SAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.826 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 61.010 | 2.800 |
High resolution limit [Å] | 2.660 | 2.660 |
Rmerge | 0.107 | 1.477 |
Number of reflections | 27284 | |
<I/σ(I)> | 19.8 | 2.1 |
Completeness [%] | 100.0 | 100 |
Redundancy | 16.8 | 16.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.2 M Na/K tartrate, MMT buffer [DL-malic acid, MES and Tris base in the molar ratios 1:2:2] (pH 5.0), 22% PEG 3350. |