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1FUP

FUMARASE WITH BOUND PYROMELLITIC ACID

Experimental procedure
Temperature [K]294
Detector technologyAREA DETECTOR
Collection date1995
DetectorSIEMENS
Spacegroup nameC 2 2 21
Unit cell lengths104.000, 219.900, 86.700
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.300
R-factor0.185
Rwork0.185
R-free0.23400
RMSD bond length0.006
RMSD bond angle21.020

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Data reduction softwareXENGEN
Phasing softwareX-PLOR
Refinement softwareX-PLOR
Data quality characteristics
 Overall
High resolution limit [Å]2.300

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Rmerge0.073

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Number of reflections44413

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Completeness [%]98.5

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Redundancy6.34

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Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

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6

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Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoircitrate300 (mM)
21reservoirPEG400014 (%)

219140

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