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2V8T

Crystal structure of Mn catalase from Thermus Thermophilus complexed with chloride

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE BW7B
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineBW7B
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1996-12-15
DetectorMARRESEARCH
Spacegroup nameP 21 3
Unit cell lengths132.070, 132.070, 132.070
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 0.980
R-factor0.101
Rwork0.101
R-free0.11700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2v8u
RMSD bond length0.021
RMSD bond angle2.028
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0000.990
High resolution limit [Å]0.9800.980
Rmerge0.0400.250
Number of reflections413309
<I/σ(I)>304
Completeness [%]98.598
Redundancy43
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.5pH 6.5

221716

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