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1UYC

Human Hsp90-alpha with 9-Butyl-8-(2,5-dimethoxy-benzyl)-9H-purin-6-ylamine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RUH3R
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2002-07-15
DetectorRAXIS IV
Spacegroup nameI 2 2 2
Unit cell lengths66.778, 90.966, 98.888
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution67.420 - 2.000
R-factor0.186
Rwork0.183
R-free0.24800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1yer
RMSD bond length0.026
RMSD bond angle2.141
Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.1.19)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.100
High resolution limit [Å]2.0002.000
Rmerge0.0620.332
Number of reflections20750
<I/σ(I)>9.13.1
Completeness [%]87.743.9
Redundancy4.83.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.525% PEG MME 2000, 0.1M NA CACODYLATE, PH6.5, 0.2M MGCL2., pH 6.50

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