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1P1B

Guanidinoacetate methyltransferase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]93
Detector technologyIMAGE PLATE
Collection date2002-01-01
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths54.150, 162.370, 55.700
Unit cell angles90.00, 96.40, 90.00
Refinement procedure
Resolution8.000 - 2.800
R-factor0.215
Rwork0.214
R-free0.28700

*

Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle27.700

*

Data scaling softwareSCALEPACK
Phasing softwareX-PLOR
Refinement softwareX-PLOR (98.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]55.000

*

2.900
High resolution limit [Å]2.8002.800
Rmerge0.067

*

0.139

*

Total number of observations122476

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Number of reflections23416

*

Completeness [%]99.4

*

88.9

*

Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5277PEG8000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirMES50 (mM)pH6.5
21reservoirdithiothreitol1 (mM)
31reservoirSAH2 (mM)
41reservoirGAA1 (mM)
51reservoirPEG80008 (%(w/v))
61dropprotein10 (mg/ml)

218853

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