5LSS
Structure of the Epigenetic Oncogene MMSET and inhibition by N-Alkyl Sinefungin Derivatives
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-02-28 |
Detector | DECTRIS PILATUS 300K |
Wavelength(s) | 0.9763 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 43.330, 77.216, 76.358 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 54.290 - 1.790 |
R-factor | 0.16452 |
Rwork | 0.162 |
R-free | 0.22581 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.011 |
RMSD bond angle | 1.417 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 54.300 |
High resolution limit [Å] | 1.790 |
Number of reflections | 109861 |
<I/σ(I)> | 18.8 |
Completeness [%] | 87.9 |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 0.1M KSCN, 31.0%w/v PEG 3350, 0.1M HEPES/NaOHpH=7 |