4TU6
Crystal structure of apo ATAD2A bromodomain with N1064 alternate conformation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 193 |
Detector technology | CCD |
Collection date | 2013-11-26 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.11587 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.980, 108.600, 77.650 |
Unit cell angles | 90.00, 103.90, 90.00 |
Refinement procedure
Resolution | 44.060 - 2.270 |
R-factor | 0.192 |
Rwork | 0.189 |
R-free | 0.24800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3dai |
RMSD bond length | 0.016 |
RMSD bond angle | 1.769 |
Data scaling software | SCALA (0.1.27) |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 61.923 | 2.340 |
High resolution limit [Å] | 2.270 | 2.270 |
Rmerge | 0.144 | 0.975 |
Number of reflections | 32012 | |
<I/σ(I)> | 7.9 | |
Completeness [%] | 99.7 | |
Redundancy | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 273 | 0.2 M Ammonium sulfate, 0.1M Bis-Tris pH 5.5, 25% w/v PEG3350 |