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1C7C

DEOXY RHB1.1 (RECOMBINANT HEMOGLOBIN)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsSIEMENS
Temperature [K]295
Detector technologyIMAGE PLATE
Collection date1998-06-15
DetectorRIGAKU RAXIS IIC
Spacegroup nameP 1 21 1
Unit cell lengths63.204, 83.357, 54.003
Unit cell angles90.00, 99.07, 90.00
Refinement procedure
Resolution8.000 - 1.800
R-factor0.176

*

R-free0.22700

*

Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1aby
RMSD bond length0.005
RMSD bond angle0.016
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareCNS
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.900
High resolution limit [Å]1.8001.800
Rmerge0.0490.247
Total number of observations143808

*

Number of reflections45597
<I/σ(I)>33.39.26
Completeness [%]89.094.1
Redundancy3.2

*

3.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Batch method

*

7

*

PERUTZ, J.CRYST.GROWTH 2(1968)54-56, pH 6.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
111ammonium phosphate10 (mM)

229183

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