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4PPL

Crystal structure of eCGP123 H193Q variant at pH 7.5

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron siteAustralian Synchrotron
BeamlineMX1
Temperature [K]100
Detector technologyIMAGE PLATE
DetectorRIGAKU RAXIS IV++
Spacegroup nameP 1 21 1
Unit cell lengths72.560, 83.390, 74.650
Unit cell angles90.00, 102.19, 90.00
Refinement procedure
Resolution46.210 - 2.200
R-factor0.1947
Rwork0.190
R-free0.28690
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)ECGP123 WITHOUT CHROMOPHORE WATERS AND SUBSTITUTION
RMSD bond length0.010
RMSD bond angle1.170
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareBUSTER (2.10.0)
Data quality characteristics
 Overall
Low resolution limit [Å]46.210
High resolution limit [Å]2.200
Completeness [%]99.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.429321% PEG 3350, 0.2M MgCl2, 0.1M BTP ph 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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