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1JD7

CRYSTAL STRUCTURE ANALYSIS OF THE MUTANT K300R OF PSEUDOALTEROMONAS HALOPLANCTIS ALPHA-AMYLASE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsENRAF-NONIUS FR591
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-01-16
DetectorMARRESEARCH
Wavelength(s)1.5418
Spacegroup nameC 2 2 21
Unit cell lengths70.300, 136.400, 113.500
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution25.700 - 2.250
Rwork0.179
R-free0.21500
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1aqh
RMSD bond length0.006
RMSD bond angle1.207
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.7002.300
High resolution limit [Å]2.2502.250
Rmerge0.1330.572
Number of reflections25136
<I/σ(I)>3.1
Completeness [%]95.853.9
Redundancy32
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7292MPD, Hepes, pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 292K

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