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3PMC

Crystal structure of the sporulation inhibitor pXO2-61 from Bacillus anthracis

Replaces:  1YKU
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL9-2
Synchrotron siteSSRL
BeamlineBL9-2
Temperature [K]100
Detector technologyCCD
Collection date2004-05-13
DetectorADSC QUANTUM 4
Wavelength(s)0.97923
Spacegroup nameP 21 21 21
Unit cell lengths44.110, 62.620, 124.760
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.640 - 1.490
R-factor0.17582
Rwork0.174
R-free0.20846
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.207
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.6401.540
High resolution limit [Å]1.4901.490
Rmerge0.0760.032
Number of reflections56717
<I/σ(I)>43.8
Completeness [%]98.994.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1EVAPORATION7.529820% PEG3350, 1M NaI, 0.1 M TrisHCl, pH 7.5, EVAPORATION, temperature 298K

220113

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