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2QSP

Bovine Hemoglobin at pH 5.7

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]93
Detector technologyCCD
Collection date2006-06-15
DetectorBRUKER PROTEUM-R
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths65.033, 78.273, 109.085
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution63.630 - 1.850
R-factor0.19027
Rwork0.187
R-free0.25768
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1g0a
RMSD bond length0.016
RMSD bond angle1.525
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]63.6301.900
High resolution limit [Å]1.8501.850
Number of reflections52808
Completeness [%]99.6
Redundancy7.43.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.72980.4 M Na Cacodylate 12-15% PEG 3350, pH 5.7, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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