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2VMO

Crystal structure of N341AbsSHMT Gly external aldimine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]100
Detector technologyIMAGE PLATE
DetectorMARRESEARCH
Spacegroup nameP 21 21 2
Unit cell lengths61.289, 106.369, 57.249
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution22.440 - 1.740
R-factor0.18
Rwork0.178
R-free0.20500
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1kl1
RMSD bond length0.008
RMSD bond angle1.092
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareREFMAC
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.800
High resolution limit [Å]1.7401.740
Rmerge0.0600.400
Number of reflections536490
<I/σ(I)>27.93.8
Completeness [%]99.598
Redundancy5.55.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.550 % MPD, 0.1 M HEPES PH 7.5, 0.2 MM EDTA, 5 MM 2-MERCAPTOETHANOL, 10 MM GLY

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