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2G3X

Crystal structure of Transthyretin mutant I84S at acidic pH

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2005-03-12
DetectorADSC QUANTUM 210
Wavelength(s)0.98
Spacegroup nameP 21 21 2
Unit cell lengths42.280, 85.420, 61.899
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution32.320 - 1.580
R-factor0.208
Rwork0.208
R-free0.24100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1f41
RMSD bond length0.005
RMSD bond angle1.300
Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((SCALA))
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]32.3201.680
High resolution limit [Å]1.5801.580
Number of reflections30436
<I/σ(I)>6.92.4
Completeness [%]99.899.7
Redundancy77.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.629815% PEG monomethyl ether, 0.1M ammonium sulphate, 50mM sodium acetate pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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