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8BQC

CjCel5B endo-glucanase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2021-04-03
DetectorDECTRIS EIGER2 XE 16M
Wavelength(s)0.9763
Spacegroup nameP 1 21 1
Unit cell lengths45.339, 53.481, 63.224
Unit cell angles90.00, 109.75, 90.00
Refinement procedure
Resolution42.050 - 1.570
Rwork0.184
R-free0.22670
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1tvn
RMSD bond length0.007
RMSD bond angle1.338
Data reduction softwareautoPROC
Data scaling softwareautoPROC
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.0501.600
High resolution limit [Å]1.5701.570
Rmerge0.1472.693
Rmeas0.1602.910
Rpim0.0621.093
Number of reflections353791983
<I/σ(I)>7.70.7
Completeness [%]88.5100
Redundancy6.56.9
CC(1/2)0.9980.320
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.5277PS: 10 mg/mL in 5 mM Na-MOPS pH 7.5, 25 mM NaCl 1:1 with WS containing 0.2 M LiCl, 20% PEG3350

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