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3LR7

Ferric horse heart myoglobin, nitrite adduct

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RUH3R
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2009-09-19
DetectorRIGAKU RAXIS IV++
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths35.266, 28.532, 62.932
Unit cell angles90.00, 105.43, 90.00
Refinement procedure
Resolution21.850 - 1.600
R-factor0.1957
Rwork0.193
R-free0.24750
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR): 1dwr
RMSD bond length0.007
RMSD bond angle0.993
Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.5_2))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]21.8501.660
High resolution limit [Å]1.6001.600
Rmerge0.0560.298
Number of reflections15927
<I/σ(I)>9.93
Completeness [%]98.096
Redundancy32.96
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1seeding7.42952.76M ammonium sulfate, 100 mM TrisHCl, 1 mM EDTA, pH 7.4, seeding, temperature 295K

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