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1IJN

Crystal structure of the transthyretin mutant TTR C10A/Y114C

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM14
Synchrotron siteESRF
BeamlineBM14
Temperature [K]100
Detector technologyCCD
Collection date2000-07-31
DetectorMARRESEARCH
Wavelength(s)0.934
Spacegroup nameP 21 21 2
Unit cell lengths43.150, 85.235, 64.797
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.920 - 1.700
R-factor0.2072
Rwork0.204
R-free0.23700
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1f41
RMSD bond length0.008
RMSD bond angle1.268
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.760
High resolution limit [Å]1.7001.700
Rmerge0.0340.222
Number of reflections26695
<I/σ(I)>24.54.7
Completeness [%]98.193
Redundancy3.32.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP529840% PEG 550 monomethyl ether, 0.1M sodium citrate, 0.1M ammonium sulphate, 0.1% BME, pH 5.0, VAPOR DIFFUSION, HANGING DROP at 298K, temperature 298.0K

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