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9JML

NADP-dependent oxidoreductase complexed with NADP and substrate 1

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL18U1
Synchrotron siteSSRF
BeamlineBL18U1
Temperature [K]100
Detector technologyPIXEL
Collection date2021-07-16
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.97915
Spacegroup nameP 41 21 2
Unit cell lengths86.993, 86.993, 225.878
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution59.350 - 2.020
R-factor0.1835
Rwork0.181
R-free0.22310
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle0.910
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwarePHASER
Refinement softwarePHENIX ((???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]81.1802.130
High resolution limit [Å]2.0202.020
Number of reflections576838037
<I/σ(I)>17.9
Completeness [%]99.6
Redundancy12.1
CC(1/2)0.9990.824
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP277.15PEG3350,sodium chloride,bis-tris hydrochloride

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