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1RG9

S-Adenosylmethionine synthetase complexed with SAM and PPNP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]93
Detector technologyIMAGE PLATE
Collection date2003-01-01
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths225.820, 69.130, 118.230
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution10.000 - 2.500
R-factor0.212
Rwork0.211
R-free0.24200

*

Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle27.500

*

Data scaling softwareSCALEPACK
Phasing softwareX-PLOR
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.600
High resolution limit [Å]2.5002.500
Rmerge0.093

*

0.187

*

Total number of observations165302

*

Number of reflections46081
Completeness [%]95.078
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP823

*

PEG-8000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 296K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirPEG80008 (%(v/w))
21reservoirTris-HCl50 (mM)pH8.0
31reservoir200 (mM)
41reservoirdithiothreitol1 (mM)
51reservoirethylene glycol20 (%)
61dropHEPES-K+50 (mM)
71dropprotein20 (mg/ml)

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PDB entries from 2024-05-15

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