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6C3N

Crystal structure of BCL6 BTB domain in complex with compound 7CC5

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]100
Detector technologyCCD
Collection date2015-10-21
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97857
Spacegroup nameP 21 21 21
Unit cell lengths34.103, 85.065, 117.750
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution35.639 - 2.532
R-factor0.210066088749
Rwork0.207
R-free0.26752
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1r29
RMSD bond length0.004
RMSD bond angle0.675
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwarePHENIX (1.11.1_2575)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.620
High resolution limit [Å]2.5302.530
Rmerge0.1160.438
Number of reflections119201054
<I/σ(I)>16.6
Completeness [%]84.4
Redundancy6.3
CC(1/2)0.9930.913
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2771.6 M ammonium formate, .1 M Tris, pH 7.5

217705

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