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3KCP

Crystal structure of interacting Clostridium thermocellum multimodular components

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F1
Synchrotron siteCHESS
BeamlineF1
Temperature [K]100
Detector technologyCCD
Collection date2005-07-26
DetectorADSC QUANTUM 270
Wavelength(s)0.9179
Spacegroup nameP 21 21 2
Unit cell lengths169.977, 58.019, 56.150
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.490 - 1.940
R-factor0.20567
Rwork0.206
R-free0.23109
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.019
RMSD bond angle1.679
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.4902.050
High resolution limit [Å]1.9401.940
Rmerge0.0660.424
Number of reflections41456
<I/σ(I)>9.63.2
Completeness [%]98.798.7
Redundancy6.85.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5294100 mM MES, 200 mM Ammonium sulfate, 30% w/v PEG 3350, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K

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