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8Z7E

Structure of G9a in complex with compound 9b

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B2
Synchrotron siteSPring-8
BeamlineBL26B2
Temperature [K]100
Detector technologyCCD
Collection date2014-10-17
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1.000
Spacegroup nameP 1 21 1
Unit cell lengths56.815, 73.956, 77.074
Unit cell angles90.00, 93.95, 90.00
Refinement procedure
Resolution44.192 - 1.545
R-factor0.1684
Rwork0.167
R-free0.19490
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle1.018
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.9_1690)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0001.580
High resolution limit [Å]1.5454.2101.550
Rmerge0.0970.0750.646
Rmeas0.1130.0870.760
Rpim0.0580.0450.397
Number of reflections9290447884640
<I/σ(I)>9.9
Completeness [%]100.0100100
Redundancy3.83.83.7
CC(1/2)0.9730.694
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.1M Bis-Tris propane (pH~7.5), 0.2M Sodium Formate or Fluoride, 10% Ethylene Glycol, ~25% PEG3350

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