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1TEF

Crystal structure of the spinach plastocyanin mutants G8D/K30C/T69C and K30C/T69C- a study of the effect on crystal packing and thermostability from the introduction of a novel disulfide bond

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMAX II BEAMLINE I711
Synchrotron siteMAX II
BeamlineI711
Temperature [K]100
Detector technologyCCD
Collection date2001-05-13
DetectorMARRESEARCH
Wavelength(s)0.991
Spacegroup nameP 32 2 1
Unit cell lengths52.320, 52.320, 127.360
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution19.200 - 1.900
R-factor0.15925
Rwork0.157
R-free0.20379
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ag6
RMSD bond length0.015
RMSD bond angle1.624
Data scaling softwareXDS
Phasing softwareAMoRE
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.1802.100
High resolution limit [Å]1.9001.900
Rmerge0.0300.047
Number of reflections16181
<I/σ(I)>53.6238.05
Completeness [%]97.394.7
Redundancy11.610.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.529321% PEG 3350, 0.25M MgCl2, 0.1M Na-acetate, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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