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4HSN

Crystal structure of DAH7PS from Neisseria meningitidis

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron siteAustralian Synchrotron
BeamlineMX2
Temperature [K]100
Detector technologyCCD
DetectorADSC QUANTUM 315r
Wavelength(s)0.9537
Spacegroup nameP 1 21 1
Unit cell lengths73.462, 137.279, 76.360
Unit cell angles90.00, 96.42, 90.00
Refinement procedure
Resolution19.790 - 2.000
R-factor0.1774
Rwork0.175
R-free0.20850
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1of8
RMSD bond length0.019
RMSD bond angle1.781
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.7902.030
High resolution limit [Å]2.0002.000
Number of reflections100515
Completeness [%]99.3100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5293.15A protein solution [11 mg/mL in 10 mM BTP buffer (pH 7.3)] was mixed 1:1 (v/v) with a reservoir solution containing 0.2 M trimethylamine N-oxide, 0.1 M Tris (pH 8.5), 15% 20% (w/v) PEG 2000 mme, 0.4 mM MnSO4. The drop sizes were 2 uL, and the volume of the reservoir solution was 500 uL, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K

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