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4M1P

Crystal structure of the copper-sensing repressor CsoR with Cu(I) from Geobacillus thermodenitrificans NG80-2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 4.2.2
Synchrotron siteALS
Beamline4.2.2
Temperature [K]113
Detector technologyCCD
Collection date2013-05-09
DetectorNOIR-1
Wavelength(s)1.0
Spacegroup nameP 6 2 2
Unit cell lengths89.204, 89.204, 57.985
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution46.375 - 2.564
R-factor0.2173
Rwork0.214
R-free0.24830
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4adz
RMSD bond length0.005
RMSD bond angle0.750
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((phenix.refine: 1.8.1_1168))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.610
High resolution limit [Å]2.5702.570
Rmerge0.0670.800
Number of reflections4463
<I/σ(I)>30.911.94
Completeness [%]99.8100
Redundancy11.310.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7293.152.8M sodium formate, 0.1M HEPES, 0.1M betaine hydrochloride, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K

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