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1Y21

Crystal Structure of Cimex Nitrophorin NO Complex

Replaces:  1NZH
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2002-08-01
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths48.065, 41.477, 65.346
Unit cell angles90.00, 94.55, 90.00
Refinement procedure
Resolution64.550 - 1.750
R-factor0.1696
Rwork0.168
R-free0.20828
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1ntf
RMSD bond length0.023
RMSD bond angle1.831
Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwareMLPHARE
Refinement softwareREFMAC (5.1.22)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]64.5501.810
High resolution limit [Å]1.7501.750
Number of reflections24549
<I/σ(I)>202.6
Completeness [%]98.798.4
Redundancy3.32.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.6298PEG 4000, pH 8.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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