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3UVA

Crystal structure of L-rhamnose isomerase mutant W38F from Bacillus halodurans in complex with Mn

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPAL/PLS BEAMLINE 4A
Synchrotron sitePAL/PLS
Beamline4A
Temperature [K]100
Detector technologyCCD
Collection date2010-06-11
DetectorADSC QUANTUM 210
Wavelength(s)1.00000
Spacegroup nameP 1 21 1
Unit cell lengths83.374, 164.779, 92.816
Unit cell angles90.00, 117.01, 90.00
Refinement procedure
Resolution45.870 - 2.690
R-factor0.18958
Rwork0.185
R-free0.26597
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.015
RMSD bond angle1.694
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.750
High resolution limit [Å]2.6902.692
Number of reflections53466
<I/σ(I)>2.5
Completeness [%]88.391.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION628310 % (w/v) PEG 8000, 0.1M HEPES pH 6.0, 0.2M sodium acetate , VAPOR DIFFUSION, temperature 283K

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