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3B2M

Crystal Structure of the Major Pilin from Streptococcus pyogenes

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-11-28
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54178
Spacegroup nameP 1 21 1
Unit cell lengths67.309, 52.308, 128.053
Unit cell angles90.00, 97.33, 90.00
Refinement procedure
Resolution66.800 - 2.220
R-factor0.203
Rwork0.200
R-free0.26400
Structure solution methodSIR
RMSD bond length0.011
RMSD bond angle1.271
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHARP
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]66.8002.300
High resolution limit [Å]2.2202.220
Rmerge0.0700.682
Number of reflections42842
<I/σ(I)>13.865.2
Completeness [%]97.592.4
Redundancy9.68.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52910.2M sodium formate, 20% PEG 3350, 0.2M HEPES-HCl pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K

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