5V37
Crystal structure of SMYD3 with SAM and EPZ028862
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-11-19 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.818, 65.868, 107.015 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 17.260 - 1.420 |
R-factor | 0.23 |
Rwork | 0.228 |
R-free | 0.27890 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.359 |
Data reduction software | KYLIN |
Data scaling software | KYLIN |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 17.260 | 1.450 |
High resolution limit [Å] | 1.410 | 1.420 |
Rmerge | 0.074 | 0.346 |
Number of reflections | 75322 | |
<I/σ(I)> | 8.8 | 2.6 |
Completeness [%] | 97.7 | 85.9 |
Redundancy | 5.8 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.10 M Magnesium formate, 0.1M Tris 8.0, 14% w/v PEG 3350 |