6ARJ
Crystal structure of CARM1 with EPZ022302 and SAH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-02-27 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.95370 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 75.164, 98.802, 208.293 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.110 - 1.920 |
R-factor | 0.177 |
Rwork | 0.175 |
R-free | 0.21160 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.432 |
Data reduction software | Aimless (0.2.17) |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.110 | 1.960 |
High resolution limit [Å] | 1.920 | 1.920 |
Rmerge | 0.082 | 0.774 |
Rmeas | 0.089 | 0.836 |
Rpim | 0.033 | 0.311 |
Number of reflections | 118082 | 5603 |
<I/σ(I)> | 13.3 | |
Completeness [%] | 99.8 | 97.2 |
Redundancy | 7.3 | 7.1 |
CC(1/2) | 0.999 | 0.820 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.2 M Ammonium Sulfate, 0.1 M Tris pH 8.5, 18% w/v PEG3350 |