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8OMW

Crystal structure of the titin domain Fn3-20

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyPIXEL
Collection date2014-10-17
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.979
Spacegroup nameC 1 2 1
Unit cell lengths49.034, 34.263, 63.081
Unit cell angles90.00, 99.68, 90.00
Refinement procedure
Resolution31.090 - 1.050
R-factor0.1501
Rwork0.149
R-free0.17750
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle1.273
Data reduction softwarexia2
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.20.1_4487)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]31.0901.090
High resolution limit [Å]1.0501.050
Rmerge0.627
Number of reflections479374253
<I/σ(I)>163.69
Completeness [%]98.088.64
Redundancy1414
CC(1/2)0.7740.612
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29310mM Tris-HCl pH 7.5 50mM NaCl 0.5mM DTT 0.1M TBG pH 9.0 25% w/v PEG 1500

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