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6IX7

The structure of LepI C52A in complex with SAH and substrate analogue

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U1
Synchrotron siteSSRF
BeamlineBL17U1
Temperature [K]100
Detector technologyPIXEL
Collection date2018-04-14
DetectorDECTRIS EIGER X 16M
Wavelength(s)0.97915
Spacegroup nameC 1 2 1
Unit cell lengths161.281, 62.133, 113.591
Unit cell angles90.00, 113.66, 90.00
Refinement procedure
Resolution32.961 - 1.835
R-factor0.181
Rwork0.181
R-free0.19110
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6ix3
RMSD bond length0.007
RMSD bond angle0.903
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX (v1.12_2829)
Refinement softwarePHENIX (v1.12_2829)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.8301.830
Rmerge0.1011.647
Rpim0.0350.555
Number of reflections891266607
<I/σ(I)>35
Completeness [%]98.7
Redundancy9.1
CC(1/2)0.9960.920
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2980.1M magnesium chloride hexahydrate, 0.1M ADA(pH 6.5), 12%(w/v) PEG 6000

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