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3LHV

Crystal structure of the mutant V182A.I199A.V201A of orotidine 5'-monophosphate decarboxylase from Methanobacterium thermoautotrophicum complexed with inhibitor BMP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4A
Synchrotron siteNSLS
BeamlineX4A
Temperature [K]100
Detector technologyCCD
Collection date2009-07-17
DetectorADSC QUANTUM 4
Wavelength(s)0.97915
Spacegroup nameP 1 21 1
Unit cell lengths64.789, 64.162, 102.427
Unit cell angles90.00, 91.99, 90.00
Refinement procedure
Resolution24.900 - 1.350
R-factor0.231
Rwork0.231
R-free0.25000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3g18
RMSD bond length0.004
RMSD bond angle1.100
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareBALBES
Refinement softwareCNS (1.2)
Data quality characteristics
 Overall
Low resolution limit [Å]25.000
High resolution limit [Å]1.350
Rmerge0.066
Number of reflections167558
Completeness [%]90.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.529325% PEG 3350, 0.1M Tris, 0.2M magnesium chloride, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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