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2BGI

X-Ray Structure of the Ferredoxin-NADP(H) Reductase from Rhodobacter capsulatus complexed with three molecules of the detergent n-heptyl- beta-D-thioglucoside at 1.7 Angstroms

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Detector technologyCCD
Collection date2004-05-17
DetectorADSC CCD
Spacegroup nameP 31 2 1
Unit cell lengths120.848, 120.848, 50.709
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution45.640 - 1.680
R-factor0.221
Rwork0.221
R-free0.22500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1a8p
RMSD bond length0.007
RMSD bond angle1.600
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.6001.800
High resolution limit [Å]1.7001.700
Rmerge0.1200.650
Number of reflections61984
<I/σ(I)>11.22.6
Completeness [%]97.290
Redundancy7.37.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.5pH 6.50

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