2F68
Crystal structure of collagen adhesin (CNA) from S. aureus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-08-20 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.982, 106.427, 44.083 |
Unit cell angles | 90.00, 116.44, 90.00 |
Refinement procedure
Resolution | 52.000 - 1.950 |
R-factor | 0.292 |
Rwork | 0.195 |
R-free | 0.25300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.734 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.000 | 1.920 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.030 | 0.090 |
Number of reflections | 28383 | |
<I/σ(I)> | 36 | 1.35 |
Completeness [%] | 95.8 | 70 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 295 | 3.2 M Ammonium Sulfate, 0.1 M NaCl, 0.05 M Hepes, PH. 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 295K |