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1OQF

Crystal structure of the 2-methylisocitrate lyase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsSIEMENS
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2002-10-09
DetectorMARRESEARCH
Wavelength(s)1.5418
Spacegroup nameP 32 2 1
Unit cell lengths83.036, 83.036, 166.872
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 1.930
Rwork0.191
R-free0.24700
Structure solution methodMIR
RMSD bond length0.011
RMSD bond angle1.500
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.930
High resolution limit [Å]1.8601.860
Rmerge0.0560.290
Number of reflections52853
<I/σ(I)>20.662.11
Completeness [%]93.168.2
Redundancy4.35
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP72981.6 M ammonium sulfate, 0.1M HEPES, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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