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3LGN

Crystal structure of IsdI in complex with heme

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCLSI BEAMLINE 08ID-1
Synchrotron siteCLSI
Beamline08ID-1
Temperature [K]100
Detector technologyCCD
Collection date2008-11-08
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97934
Spacegroup nameP 21 21 21
Unit cell lengths58.240, 66.780, 69.430
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution44.620 - 1.500
R-factor0.183
Rwork0.181
R-free0.21400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2zdp
RMSD bond length0.009
RMSD bond angle1.118
Data reduction softwareMOSFLM
Data scaling softwareSCALA (3.3.15)
Refinement softwareREFMAC
Data quality characteristics
 Overall
Low resolution limit [Å]69.430
High resolution limit [Å]1.500
Number of reflections43991
Completeness [%]99.8
Redundancy6.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.527725% polyethylene glycol 3350, 0.2M MgCl2, 0.1M Bis-Tris buffer pH 5.5, and flash frozen with a cryoprotectant of 10% ethylene glycol, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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