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1UKP

Crystal structure of soybean beta-amylase mutant substituted at surface region

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyCCD
Collection date2002-04-17
DetectorOXFORD PX210
Wavelength(s)0.900
Spacegroup nameP 1
Unit cell lengths75.463, 78.801, 88.560
Unit cell angles89.92, 90.21, 89.90
Refinement procedure
Resolution10.000 - 2.100
R-factor0.2
Rwork0.200
R-free0.23450

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Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1byb
RMSD bond length0.006
RMSD bond angle1.273

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Data reduction softwared*TREK
Data scaling softwared*TREK
Phasing softwareCNS (1.1)
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.9802.070
High resolution limit [Å]2.0002.000
Rmerge0.1210.383
Total number of observations335804

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Number of reflections13775113776

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Completeness [%]95.495.3
Redundancy2.44
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.44

*

ammonium sulfate, sodium acetate, 2-mercaptoethanol, EDTA, pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 277.0K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21reservoirammonium sulfate45-50 (%)
31reservoirEDTA1 (mM)
41reservoir2-ME18 (mM)
51reservoirsodium acetate0.1 (M)pH5.4

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