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Adenine-specific DNA methyltransferase M.BseCI complexed with AdoHcy and cognate unmethylated DNA duplex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE X12
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineX12
Temperature [K]100
Detector technologyCCD
Collection date2005-09-09
DetectorMAR CCD 165 mm
Wavelength(s)1.1
Spacegroup nameP 61
Unit cell lengths87.040, 87.040, 156.350
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution28.490 - 2.300
R-factor0.1986
Rwork0.197
R-free0.22380
Structure solution methodSAD
RMSD bond length0.004
RMSD bond angle0.731
Data reduction softwareiMOSFLM
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.19.2_4158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.9102.260
High resolution limit [Å]2.2002.200
Number of reflections383013358
<I/σ(I)>22.82
Completeness [%]99.598.5
Redundancy1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5289PEG 400, Tris-HCl, KCl, magnesium chloride

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