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6YQ3

Promiscuous Reductase LugOII Catalyzes Keto-reduction at C1 during Lugdunomycin Biosynthesis

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL15A1
Synchrotron siteNSRRC
BeamlineBL15A1
Temperature [K]298
Detector technologyCCD
Collection date2019-07-26
DetectorADSC QUANTUM 315
Wavelength(s)1.0
Spacegroup nameI 1 2 1
Unit cell lengths87.969, 60.214, 88.308
Unit cell angles90.00, 102.46, 90.00
Refinement procedure
Resolution24.696 - 1.570
Rwork0.142
R-free0.16630
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4osp
RMSD bond length0.017
RMSD bond angle2.114
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.7001.610
High resolution limit [Å]1.5701.570
Rmerge0.0530.464
Rmeas0.0640.566
Number of reflections605256124
<I/σ(I)>22.52.7
Completeness [%]98.1
Redundancy2.92.8
CC(1/2)0.9990.818
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29120% PEG 3350, 0.1 M Na Malonate, 0.1 M BIS-TRIS prop, pH 6.5

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