6MJX
human cGAS catalytic domain bound with cGAMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-21 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9793 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 128.006, 50.424, 59.969 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.984 - 2.600 |
R-factor | 0.2257 |
Rwork | 0.221 |
R-free | 0.26500 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.602 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.984 | 2.640 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.070 | |
Rmeas | 0.083 | 0.313 |
Rpim | 0.044 | 0.166 |
Number of reflections | 11586 | 1186 |
<I/σ(I)> | 15.4 | 4.5 |
Completeness [%] | 92.7 | 97.9 |
Redundancy | 3.4 | 3.1 |
CC(1/2) | 0.952 | 0.949 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293 | 0.1M Bicine 8.5, 10% PEG6000, final PH 9.0 |