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2EEX

Crystal structure of Cel44A, GH family 44 endoglucanase from Clostridium thermocellum

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]100
Detector technologyCCD
Collection date2005-11-05
DetectorADSC QUANTUM 315
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths47.944, 59.120, 171.113
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.720 - 2.000
R-factor0.165
Rwork0.165
R-free0.20100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2e4t
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.070
High resolution limit [Å]2.0002.000
Number of reflections32781
<I/σ(I)>12.254.18
Completeness [%]96.981.7
Redundancy4.83.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.82930.1M MES-NaOH pH5.8, 16% (w/v) PEG MME 550, 6mM ZnSO4, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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