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1WZ9

The 2.1 A structure of a tumour suppressing serpin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-10-02
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths54.115, 95.047, 139.225
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution78.570 - 2.100
R-factor0.20729
Rwork0.205
R-free0.24933
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1xu8
RMSD bond length0.008
RMSD bond angle1.152
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 Overall
Low resolution limit [Å]78.600
High resolution limit [Å]2.100
Rmerge0.045
Number of reflections42714
<I/σ(I)>22.2
Completeness [%]99.8
Redundancy36.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.32950.1M BisTris, 2.9M (NH4)2SO4, pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 295K

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