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1S6V

Structure of a cytochrome c peroxidase-cytochrome c site specific cross-link

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL7-1
Synchrotron siteSSRL
BeamlineBL7-1
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2003-03-24
DetectorMARRESEARCH
Wavelength(s)1.08
Spacegroup nameP 1 21 1
Unit cell lengths45.240, 107.920, 88.380
Unit cell angles90.00, 104.42, 90.00
Refinement procedure
Resolution45.650 - 1.880
R-factor0.19
Rwork0.190
R-free0.24300
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.600
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.910
High resolution limit [Å]1.8801.880
Rmerge0.0540.573
Number of reflections60567
<I/σ(I)>13.33
Completeness [%]91.985.9
Redundancy43.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP298PEG 3350, KI, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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