6HOS
Structure of the KpFlo2 adhesin domain in complex with glycerol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-05-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.91841 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 79.943, 103.186, 72.099 |
Unit cell angles | 90.00, 113.51, 90.00 |
Refinement procedure
Resolution | 39.409 - 2.150 |
R-factor | 0.1734 |
Rwork | 0.172 |
R-free | 0.19890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5a3l |
RMSD bond length | 0.004 |
RMSD bond angle | 0.609 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.670 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.071 | 0.561 |
Number of reflections | 29204 | |
<I/σ(I)> | 11.7 | 2.4 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.7 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 291 | 30 mg/ml protein, 20 mM MgCl2, 200 mM sodium cacodylate, 50% (V/v) PEG200 |