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5FU2

The complexity of the Ruminococcus flavefaciens cellulosome reflects an expansion in glycan recognition

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04
Synchrotron siteDiamond
BeamlineI04
Temperature [K]100
Detector technologyPIXEL
Collection date2015-07-31
DetectorDECTRIS PILATUS 6M
Spacegroup nameP 21 21 21
Unit cell lengths45.623, 47.272, 83.958
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution41.980 - 1.400
R-factor0.16019
Rwork0.158
R-free0.19976
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5aot
RMSD bond length0.010
RMSD bond angle1.636
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0135)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.2701.420
High resolution limit [Å]1.4001.400
Rmerge0.0600.980
Number of reflections36544
<I/σ(I)>17.41.9
Completeness [%]100.0100
Redundancy7.17.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1200 MM CACL2 100 MM NA ACETATE PH 5.0 20% W/V PEG 6000

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