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2WOV

Trypanosoma brucei trypanothione reductase with bound NADP.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2009-01-13
DetectorRIGAKU RAXIS IV
Spacegroup nameP 1 21 1
Unit cell lengths100.870, 63.450, 169.350
Unit cell angles90.00, 97.85, 90.00
Refinement procedure
Resolution19.847 - 2.500
R-factor0.182
Rwork0.179
R-free0.25080
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2woi
RMSD bond length0.017
RMSD bond angle1.730
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0088)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.9002.560
High resolution limit [Å]2.5002.500
Rmerge0.1100.400
Number of reflections72546
<I/σ(I)>14.83.6
Completeness [%]93.385.6
Redundancy3.63.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
115MG/ML PROTEIN IN 25MM HEPES PH 7.5 AND 50MM NABR EQUILIBRATED AGAINST 24% MPD, 10% PEG3350 AND 40MM IMIDAZOLE PH 8.0.

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