3GT2
Crystal Structure of the P60 Domain from M. avium paratuberculosis Antigen MAP1272c
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 97 |
Detector technology | CCD |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.9724 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 34.715, 53.212, 38.325 |
Unit cell angles | 90.00, 102.95, 90.00 |
Refinement procedure
Resolution | 22.675 - 1.750 |
R-factor | 0.1848 |
Rwork | 0.183 |
R-free | 0.20080 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.971 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASES |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 500.000 | 1.810 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.072 | 0.216 |
Number of reflections | 13278 | |
<I/σ(I)> | 9.446 | |
Completeness [%] | 96.1 | 78.1 |
Redundancy | 3.6 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.3 | 273 | 0.1 M BisTris-HCl, 1.6 M Ammonium Sulfate, 4% (v/v) PEG 400, pH 6.3, VAPOR DIFFUSION, HANGING DROP, temperature 273K |