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3FFY

Putative tetrapyrrole (corrin/porphyrin) methyltransferase from Bacteroides fragilis.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2008-10-29
DetectorADSC QUANTUM 315
Wavelength(s)0.9792
Spacegroup nameP 41 21 2
Unit cell lengths60.536, 60.536, 96.065
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution39.100 - 2.000
R-factor0.207
Rwork0.206
R-free0.23100
Structure solution methodSAD
RMSD bond length0.020
RMSD bond angle1.758
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHELXD
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]39.1002.030
High resolution limit [Å]2.0002.000
Rmerge0.0670.709
Number of reflections11909
<I/σ(I)>40.0872.08
Completeness [%]94.157.4
Redundancy97.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.52941.26 M ammonium sulfate, 0.1 M acetate buffer, 0.2 M sodium chloride, pH 4.5, VAPOR DIFFUSION, SITTING DROP, temperature 294K

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