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2XVM

Crystal structure of the tellurite detoxification protein TehB from E. coli in complex with SAH

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyCCD
Collection date2010-08-07
DetectorADSC CCD
Spacegroup nameC 1 2 1
Unit cell lengths130.362, 55.644, 59.420
Unit cell angles90.00, 97.72, 90.00
Refinement procedure
Resolution28.260 - 1.480
R-factor0.17337
Rwork0.170
R-free0.22976
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2i6g
RMSD bond length0.021
RMSD bond angle1.912
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0106)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]28.2001.560
High resolution limit [Å]1.4801.480
Rmerge0.0600.430
Number of reflections69781
<I/σ(I)>16.12.7
Completeness [%]98.996.2
Redundancy5.32.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
180.2M NAF, 22% PEG3350, 1MM SAM, pH 8

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