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3UHR

HBI (L36F) deoxy

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]298
Detector technologyIMAGE PLATE
Collection date2005-02-11
DetectorMAR scanner 345 mm plate
Spacegroup nameC 2 2 21
Unit cell lengths91.620, 44.380, 143.900
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution28.290 - 1.900
R-factor0.166
Rwork0.166
R-free0.19100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4sdh
RMSD bond length0.006
RMSD bond angle1.200
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.070
High resolution limit [Å]1.9001.900
Rmerge0.0620.202
Number of reflections21467
<I/σ(I)>14.93.9
Completeness [%]90.665
Redundancy2.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1SMALL TUBES8.52981.5-2.5 M phosphate, pH 8.50, SMALL TUBES, temperature 298K

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