4YXM
Structure of Thermotoga maritima DisA D75N mutant with reaction product c-di-AMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-11-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.000 |
Spacegroup name | P 4 21 2 |
Unit cell lengths | 108.550, 108.550, 165.920 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.279 - 2.250 |
R-factor | 0.1906 |
Rwork | 0.189 |
R-free | 0.23730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3c1z |
RMSD bond length | 0.007 |
RMSD bond angle | 1.046 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.310 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.115 | |
Number of reflections | 47778 | |
<I/σ(I)> | 18.3 | 1.6 |
Completeness [%] | 100.0 | 100 |
Redundancy | 13.1 | 13 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 288 | 30% (v/v) MPD, 200mM Ammonium acetate, 100mM Tris-HCl |