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7U6J

HalB with lysine and succinate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]194
Detector technologyPIXEL
Collection date2019-03-22
DetectorDECTRIS PILATUS3 S 6M
Wavelength(s)1.11
Spacegroup nameP 1 21 1
Unit cell lengths70.241, 136.079, 116.240
Unit cell angles90.00, 100.02, 90.00
Refinement procedure
Resolution69.170 - 1.900
R-factor0.1642
Rwork0.162
R-free0.21120
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6nie
Data reduction softwareXDS (Jan 26,2018)
Data scaling softwareAimless (0.7.4)
Phasing softwarePHASER
Refinement softwarePHENIX (1.19.2_4158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]87.6001.930
High resolution limit [Å]1.9001.900
Number of reflections1680848185
<I/σ(I)>81.1
Completeness [%]99.698.8
Redundancy6.97
CC(1/2)0.9970.449
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.5291Equal volumes of protein solution (SwHalB (3 mg/mL), lysine (3 mM), aKG (3 mM, pH 7)) and reservoir solution (succinate phosphate lysine (SPL) buffer (100 mM), 20% (w/v) PEG 1500, pH 5.5) were mixed

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