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2NPE

An unusual twin-His arrangement in the pore of ammonia channels is essential for substrate conductance

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyCCD
Collection date2006-03-20
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.94998
Spacegroup nameP 63
Unit cell lengths109.253, 109.253, 84.387
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution15.000 - 2.100
R-factor0.21311
Rwork0.211
R-free0.25350
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1xqf
RMSD bond length0.020
RMSD bond angle1.857
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.200
High resolution limit [Å]2.1002.100
Number of reflections33189
<I/σ(I)>9.92.48
Completeness [%]99.199.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.629826% PEG 400, 0.1M SODIUM ACETATE, 0.2M MAGNESIUM SULFATE, PH 4.6, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 298K, pH 4.60

219869

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