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1VPE

CRYSTALLOGRAPHIC ANALYSIS OF PHOSPHOGLYCERATE KINASE FROM THE HYPERTHERMOPHILIC BACTERIUM THERMOTOGA MARITIMA

Experimental procedure
Temperature [K]298
Detector technologyIMAGE PLATE
Collection date1996-12
DetectorMARRESEARCH
Spacegroup nameP 21 21 2
Unit cell lengths62.009, 76.864, 87.501
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.000
R-factor0.198
Rwork0.198
R-free0.28800
Structure solution methodMULTIPLE ISOMORPHOUS REPLACEMENT
RMSD bond length0.010
RMSD bond angle1.700
Data reduction softwareMOSFLM (V. 5.23)
Data scaling softwareCCP4 ((AGROVATA)
Phasing softwareX-PLOR (3.1)
Refinement softwareX-PLOR (3.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]8.000
High resolution limit [Å]2.0002.000
Rmerge0.070
Total number of observations106055

*

Number of reflections27144
Completeness [%]93.274.3
Redundancy3.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

7

*

20

*

drop consists of equal volume of protein and reservoir solutions

*

Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein17 (mg/ml)
21dropMops5 (mM)
31dropAMP-PNP2 (mM)
41drop3-phosphoglycerate2 (mM)
51drop2 (mM)
61reservoirPEG30005 (%)
71reservoirPEG800020 (%)

219140

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