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4U63

Crystal structure of a bacterial class III photolyase from Agrobacterium tumefaciens at 1.67A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyCCD
Collection date2010-02-03
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.918420
Spacegroup nameP 32 2 1
Unit cell lengths81.867, 81.867, 195.952
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution34.300 - 1.670
R-factor0.15736
Rwork0.156
R-free0.18047
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1u3c
RMSD bond length0.008
RMSD bond angle1.229
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwareSHELXDE
Refinement softwareREFMAC (5.8.0073)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.3001.760
High resolution limit [Å]1.6701.670
Rmerge0.0850.930
Number of reflections89158
<I/σ(I)>13.72.3
Completeness [%]100.0100
Redundancy9.29
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.82823 M ammonium sulfate, 10% (v/v) glycerol, 75 mM sodium chloride, 12.5 mM tris (hydroxymethyl) amino methane, 1.25 mM ethylenediaminetetraacetic acid.

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