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1CK4

CRYSTAL STRUCTURE OF RAT A1B1 INTEGRIN I-DOMAIN.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]108
Detector technologyIMAGE PLATE
DetectorRIGAKU
Spacegroup nameP 21 21 21
Unit cell lengths34.770, 85.920, 132.560
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution100.000 - 2.200
R-factor0.234

*

Rwork0.234
R-free0.29900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1aox
RMSD bond length0.009
RMSD bond angle1.600
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareX-PLOR (3.8)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]35.000
High resolution limit [Å]2.2002.200

*

Rmerge0.056
Number of reflections19238
<I/σ(I)>20
Completeness [%]91.077.6

*

Redundancy12
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

7.5

*

pH 6.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropTris10 (mM)
21drop2-mercaptoethanol10 (mM)
31dropprotein11 (mg/ml)
41reservoirPEG800025 (%(w/v))
51reservoirsodium cacodylate0.1 (M)
61reservoirsodium acetate0.2 (M)

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