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1Y8I

Horse methemoglobin low salt, PH 7.0 (98% relative humidity)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2002-08-26
DetectorMARRESEARCH
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths62.798, 80.907, 112.159
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.600
R-factor0.167
Rwork0.167
R-free0.22800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)HORSE METHEMOGLOBIN pdb entry 2MHB
RMSD bond length0.009
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (0.4)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.690
High resolution limit [Å]2.6002.600
Rmerge0.1430.474
Number of reflections18160
Completeness [%]99.9100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1LIQUID DIFFUSION72930.01M Phosphate Buffer, 30% PEG 3350, pH 7.0, LIQUID DIFFUSION, temperature 293K

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