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4PW9

Crystal structure of the electron-transfer complex formed between a sulfite dehydrogenase and a c-type cytochrome from Sinorhizobium meliloti

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron siteAustralian Synchrotron
BeamlineMX2
Temperature [K]100
Detector technologyCCD
Collection date2011-07-15
DetectorADSC QUANTUM 315r
Wavelength(s)0.954
Spacegroup nameP 21 21 2
Unit cell lengths109.583, 95.815, 49.906
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution47.560 - 2.490
R-factor0.214
Rwork0.211
R-free0.26000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4pw3
RMSD bond length0.012
RMSD bond angle1.412
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.590
High resolution limit [Å]2.4902.500
Rmerge0.1390.766
Number of reflections18883
<I/σ(I)>5.82.1
Completeness [%]99.399.6
Redundancy3.43.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.50.2M SODIUM FORMATE, 0.1M BIS-TRIS PROPANE PH 7.5, 20% PEG 3350, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K

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