6R3E
Human DNMT3B PWWP domain in complex with triisopropanolamine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-03-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.978570 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 74.257, 74.257, 158.187 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.775 - 2.269 |
R-factor | 0.2214 |
Rwork | 0.218 |
R-free | 0.26350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qkj |
RMSD bond length | 0.008 |
RMSD bond angle | 1.001 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.776 | 2.410 |
High resolution limit [Å] | 2.269 | 2.269 |
Rmerge | 0.035 | |
Number of reflections | 45066 | 24064 |
<I/σ(I)> | 37.74 | |
Completeness [%] | 99.9 | |
Redundancy | 12.6 | |
CC(1/2) | 1.000 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1 M MES, 0.2 M Li2SO4, 23-33% PEG3350 |