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8JDF

Crystal structure of H405A mLDHD in complex with D-lactate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL02U1
Synchrotron siteSSRF
BeamlineBL02U1
Temperature [K]100
Detector technologyPIXEL
Collection date2023-04-17
DetectorDECTRIS EIGER2 S 9M
Wavelength(s)0.9792
Spacegroup nameI 2 2 2
Unit cell lengths81.120, 103.420, 122.360
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution37.940 - 1.690
R-factor0.1732
Rwork0.172
R-free0.18740
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle1.028
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.18.2_3874: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]63.8301.730
High resolution limit [Å]1.6901.690
Rmerge0.0980.918
Rmeas0.1020.970
Rpim0.0280.307
Total number of observations71690138882
Number of reflections569714065
<I/σ(I)>22.55.6
Completeness [%]98.8
Redundancy12.69.6
CC(1/2)0.9980.840
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION2894.0 M sodium formate

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