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3LV6

Crystal structure of the mutant I218F 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 date2009-11-11
DetectorADSC QUANTUM 4
Wavelength(s)0.97915
Spacegroup nameP 1 21 1
Unit cell lengths59.612, 63.211, 60.964
Unit cell angles90.00, 114.82, 90.00
Refinement procedure
Resolution32.468 - 1.451
R-factor0.1643
Rwork0.163
R-free0.18220
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3g18
RMSD bond length0.008
RMSD bond angle1.167
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareBALBES
Refinement softwarePHENIX ((phenix.refine: 1.5_2))
Data quality characteristics
 Overall
Low resolution limit [Å]32.468
High resolution limit [Å]1.450
Number of reflections65670
Completeness [%]90.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52931.4M sodium citrate, 0.1M Hepes, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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