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1A40

PHOSPHATE-BINDING PROTEIN WITH ALA 197 REPLACED WITH TRP

Experimental procedure
Source typeROTATING ANODE
Source detailsRIGAKU RUH2R
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1996-05
DetectorMACSCIENCE
Spacegroup nameP 21 21 21
Unit cell lengths41.410, 62.760, 122.730
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution15.000 - 1.700
R-factor0.203
Rwork0.203
R-free0.26900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2abh
RMSD bond length0.013
RMSD bond angle23.780

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR (3.85)
Refinement softwareX-PLOR (3.85)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]15.0001.780
High resolution limit [Å]1.7001.700
Rmerge0.086

*

0.314

*

Number of reflections35260
<I/σ(I)>84
Completeness [%]92.363.6
Redundancy63
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

4.5pH 4.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein5.5 (mg/ml)
21droppotassium phosphate15 (mM)
31reservoirPEG600020 (%(w/v))
41reservoir50 (mM)
51reservoirpotassium phosphate2 (mM)
61reservoirpotassium acetate20 (mM)

219869

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