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7O18

N-TERMINAL BROMODOMAIN OF HUMAN BRD4 WITH I-BET282

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-E+ SUPERBRIGHT
Temperature [K]100
Detector technologyCCD
Collection date2011-06-01
DetectorRIGAKU SATURN A200
Wavelength(s)1.54178
Spacegroup nameP 21 21 21
Unit cell lengths42.548, 46.293, 61.412
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.999 - 1.700
Rwork0.170
R-free0.21010
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)in house model
RMSD bond length0.006
RMSD bond angle1.392
Data reduction softwared*TREK
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]36.9701.760
High resolution limit [Å]1.7001.700
Rmerge0.0430.119
Number of reflections5102913015
<I/σ(I)>23.25.6
Completeness [%]93.961.9
Redundancy3.922.15
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION293200mM CaCl2, 25% OEG4K, 100mM Tris HCl, pH 8.5

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