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8ZAX

Crystal structure of a short-chain dehydrogenase from Lactobacillus fermentum with NADPH

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17B1
Synchrotron siteSSRF
BeamlineBL17B1
Temperature [K]100
Detector technologyPIXEL
Collection date2022-01-01
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.987
Spacegroup nameC 2 2 21
Unit cell lengths73.827, 88.818, 157.371
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution29.470 - 1.540
R-factor0.21883
Rwork0.217
R-free0.24772
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.012
RMSD bond angle1.007
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0425)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.600
High resolution limit [Å]1.5401.540
Rmerge0.1501.204
Rmeas0.154
Rpim0.0340.322
Total number of observations1348050
Number of reflections711156829
<I/σ(I)>2.61.3
Completeness [%]92.690.1
Redundancy1913.3
CC(1/2)0.9980.813
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2980.1M MES pH 6.0, 0.05M calcium chloride, 43% PEG 200

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