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5FWG

TETRA-(5-FLUOROTRYPTOPHANYL)-GLUTATHIONE TRANSFERASE

Experimental procedure
Source typeROTATING ANODE
Source detailsRIGAKU RUH2R
Temperature [K]103
Detector technologyIMAGE PLATE
Collection date1997-04-08
DetectorRIGAKU
Spacegroup nameC 1 2 1
Unit cell lengths86.939, 68.747, 80.539
Unit cell angles90.00, 105.08, 90.00
Refinement procedure
Resolution65.000 - 2.000
R-factor0.181

*

Structure solution methodMOLECULAR MODIFICATION
Starting model (for MR)3gst
RMSD bond length0.022

*

RMSD bond angle3.030

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR
Refinement softwareTNT (5E)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]65.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0660.137
Total number of observations184888

*

Number of reflections29587

*

<I/σ(I)>2015
Completeness [%]95.0

*

68.3
Redundancy6.242
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

7.622

*

pH 7.6
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21dropinhibitor2 (mM)
31dropn-octyl-beta-D-glycopyranoside0.3 (%)
41dropPEG300010 (%)
51dropHEPES100 (mM)
61reservoirPEG300024 (%)

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