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9R4P

Crystal structure of inactive (D164N) variant CtGH76 from Chaetomium thermophilum in complex with alpha-1,6-mannobiose

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyPIXEL
Collection date2021-02-23
DetectorDECTRIS PILATUS4 X 2M
Wavelength(s)0.999
Spacegroup nameP 31 2 1
Unit cell lengths107.090, 107.090, 127.267
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution49.350 - 2.460
R-factor0.2022
Rwork0.201
R-free0.22000
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle0.707
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.20.1_4487)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.3502.548
High resolution limit [Å]2.4602.460
Number of reflections309583035
<I/σ(I)>12.821.16
Completeness [%]99.3
Redundancy20
CC(1/2)0.9980.593
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP72931.0 M sodium/potassium tartrate 0.2 M lithium sulfate 0.1 M Tris pH 7.0

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