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2AHD

The Apo structure of Methanococcus jannaschii phosphodiesterase MJ0936

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.1
Synchrotron siteALS
Beamline5.0.1
Temperature [K]100
Detector technologyCCD
Collection date2002-11-26
DetectorADSC QUANTUM 210
Wavelength(s)1
Spacegroup nameC 1 2 1
Unit cell lengths209.866, 71.342, 62.969
Unit cell angles90.00, 98.13, 90.00
Refinement procedure
Resolution44.780 - 3.000
R-factor0.235
Rwork0.235
R-free0.27500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1s3m
RMSD bond length0.008
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]3.000
Number of reflections17430
Completeness [%]93.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.52930.1 M Tris-HCl, pH 8.5, 0.2 M sodium acetate, 30% PEG 4000, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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