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3B43

I-band fragment I65-I70 from titin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2004-11-03
DetectorADSC QUANTUM 210
Wavelength(s)0.9792
Spacegroup nameP 65 2 2
Unit cell lengths141.430, 141.430, 166.010
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution16.985 - 3.300
R-factor0.222
Rwork0.220
R-free0.26700
Structure solution methodMIRAS
RMSD bond length0.006
RMSD bond angle0.944
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareSHARP
Refinement softwarePHENIX
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]17.0003.350
High resolution limit [Å]3.30016.0003.300
Rmerge0.0800.0190.478
Number of reflections1495325639
<I/σ(I)>19.6544.3
Completeness [%]98.613.897.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.9298pH 4.9, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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