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3RZF

Crystal Structure of Inhibitor of kappaB kinase beta (I4122)

Replaces:  3QAD
Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-C
Synchrotron siteAPS
Beamline24-ID-C
Temperature [K]83
Detector technologyCCD
Collection date2010-02-08
DetectorADSC QUANTUM 315
Wavelength(s)0.963937, 0.979163, 0.979328
Spacegroup nameI 41 2 2
Unit cell lengths164.656, 164.656, 273.458
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution14.965 - 4.000
R-factor0.2732
Rwork0.270
R-free0.33990
Structure solution methodMAD
RMSD bond length0.048
RMSD bond angle1.747
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSHARP
Refinement softwarePHENIX ((phenix.refine: 1.6.4_486))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0004.302
High resolution limit [Å]4.0004.000
Rmerge0.0560.056
Number of reflections13319
<I/σ(I)>25.325.3
Completeness [%]97.397.3
Redundancy6.96.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION5.62771.8M K/Na phosphate, pH 5.6, VAPOR DIFFUSION, temperature 277K

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