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1N5W

Crystal Structure of the Cu,Mo-CO Dehydrogenase (CODH); Oxidized form

Replaces:  1QJ2
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMPG/DESY, HAMBURG BEAMLINE BW6
Synchrotron siteMPG/DESY, HAMBURG
BeamlineBW6
Temperature [K]110
Detector technologyIMAGE PLATE
Collection date1999-07-14
DetectorMARRESEARCH
Wavelength(s)1.05
Spacegroup nameP 21 21 21
Unit cell lengths119.295, 132.088, 159.825
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution18.000 - 1.500
R-factor0.135
Rwork0.135
R-free0.16900

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Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.017

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RMSD bond angle1.946

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Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.520
High resolution limit [Å]1.4901.490
Rmerge0.046

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Total number of observations941420

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Number of reflections387014
Completeness [%]95.965.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

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7.3279Dobbek, H., (1999) Proc.Natl.Acad.Sci.USA, 96, 8884.

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Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
1110.8 (M)
2110.8 (M)
311MPD2 (%)
411HEPES100 (mM)pH7.3

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