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5LSX

Structure of the Epigenetic Oncogene MMSET and inhibition by N-Alkyl Sinefungin Derivatives

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2013-02-28
DetectorDECTRIS PILATUS 300K
Wavelength(s)0.9763
Spacegroup nameP 21 21 21
Unit cell lengths49.244, 77.305, 78.843
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution36.750 - 2.900
R-factor0.1844
Rwork0.179
R-free0.28025
Structure solution methodFOURIER SYNTHESIS
RMSD bond length0.010
RMSD bond angle1.421
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwareREFMAC
Refinement softwareREFMAC (5.8.0135)
Data quality characteristics
 Overall
Low resolution limit [Å]55.190
High resolution limit [Å]2.700
Number of reflections54976
<I/σ(I)>15.8
Completeness [%]99.7
Redundancy6.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.1M Hepes, pH 7.3, 0.1MKSCN, 25-30%MPEG2000

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