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2XXF

Cu metallated H254F mutant of nitrite reductase

Replaces:  2JL3
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX10.1
Synchrotron siteSRS
BeamlinePX10.1
Temperature [K]100
Detector technologyCCD
Collection date2007-09-28
DetectorMARMOSAIC 225 mm CCD
Spacegroup nameH 3
Unit cell lengths89.333, 89.333, 287.851
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution95.780 - 1.500
R-factor0.14623
Rwork0.145
R-free0.17650
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1oe1
RMSD bond length0.019
RMSD bond angle2.003
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]26.0001.550
High resolution limit [Å]1.5001.500
Rmerge0.0500.270
Number of reflections133132
<I/σ(I)>18.92.95
Completeness [%]97.178.2
Redundancy3.23
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.5PEG 550 MME, ZNSO4, MES PH 6.5

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