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2VQM

Structure of HDAC4 catalytic domain bound to a hydroxamic acid inhbitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-1
Synchrotron siteESRF
BeamlineID14-1
Temperature [K]100
Detector technologyCCD
Collection date2006-02-20
DetectorADSC CCD
Spacegroup nameC 2 2 21
Unit cell lengths108.866, 138.208, 69.603
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 1.800
R-factor0.221
Rwork0.219
R-free0.25600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2vqj
RMSD bond length0.010
RMSD bond angle1.389
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]70.0001.850
High resolution limit [Å]1.8001.800
Rmerge0.0700.580
Number of reflections48786
<I/σ(I)>16.92.7
Completeness [%]99.799.7
Redundancy77.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.41.5M AMMONIUM SULPHATE 0.1M MES PH 6.4 10% DIOXANE 1MM DTT

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