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5SW5

Crystal structure of native catalase-peroxidase KatG at pH7.5

Replaces:  2B2Q
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM16
Synchrotron siteESRF
BeamlineBM16
Temperature [K]100
Detector technologyCCD
Collection date2005-02-18
DetectorMARRESEARCH
Wavelength(s)1.00801
Spacegroup nameP 21 21 21
Unit cell lengths100.343, 114.851, 174.860
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.050
R-factor0.1505
Rwork0.149
R-free0.18430
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1MWV
RMSD bond length0.025
RMSD bond angle2.141
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.8.0151)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]96.0002.100
High resolution limit [Å]2.0502.050
Number of reflections119529
<I/σ(I)>132.2
Completeness [%]99.394.4
Redundancy4.43.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29316-20% MPD, 0.1 M sodium citrate pH 7.6

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