2VQV
Structure of HDAC4 catalytic domain with a gain-of-function mutation bound to a hydroxamic acid inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-01-18 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 86.524, 70.766, 89.011 |
Unit cell angles | 90.00, 108.57, 90.00 |
Refinement procedure
Resolution | 30.000 - 3.300 |
R-factor | 0.235 |
Rwork | 0.234 |
R-free | 0.26500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vqj |
RMSD bond length | 0.007 |
RMSD bond angle | 1.087 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 3.480 |
High resolution limit [Å] | 3.300 | 3.300 |
Rmerge | 0.180 | 0.450 |
Number of reflections | 12577 | |
<I/σ(I)> | 6.7 | 2 |
Completeness [%] | 98.2 | 99.5 |
Redundancy | 2.9 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1M MES PH 6.5, 1.6M AMMONIUM SULPHATE, 10% DIOXANE 1MM DTT |