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4MAN

Bcl_2-Navitoclax Analog (with Indole) Complex

Replaces:  4LXE
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]110
Detector technologyCCD
Collection date2008-06-13
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.0
Spacegroup nameP 43
Unit cell lengths71.375, 71.375, 101.492
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution18.370 - 2.070
R-factor0.2142
Rwork0.213
R-free0.23360
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle1.040
Data reduction softwareDENZO
Data scaling softwareHKL-2000
Phasing softwareAMoRE
Refinement softwareBUSTER (2.11.4)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]18.3702.140
High resolution limit [Å]2.0702.070
Number of reflections30912
Completeness [%]99.999.88
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION8.52961.5 M Li2SO4, 0.1 M Tris HCl, pH 8.5, VAPOR DIFFUSION, temperature 296K

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