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2EB9

Crystal Structure of Cu(II)(Sal-Leu)/apo-Myoglobin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-02-06
DetectorRIGAKU RAXIS VII
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths32.580, 57.901, 75.282
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution23.030 - 1.800
R-factor0.19162
Rwork0.189
R-free0.23948
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1v9q
RMSD bond length0.016
RMSD bond angle1.477
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.8001.800
Rmerge0.0910.266
Number of reflections13338
<I/σ(I)>37.87
Completeness [%]96.392.6
Redundancy9.76.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.82771.37M Sodium, Pottasium phosphate, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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