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7C39

Crystal structure of AofleA from Arthrobotrys oligospora in complex with methylated L-fucose

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]100
Detector technologyPIXEL
Collection date2018-10-19
DetectorDECTRIS EIGER X 16M
Wavelength(s)0.9792
Spacegroup nameP 21 21 21
Unit cell lengths75.832, 77.103, 136.841
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.420 - 1.850
R-factor0.1541
Rwork0.152
R-free0.18490
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7c37
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.14_3260)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0001.920
High resolution limit [Å]1.8503.9901.850
Rmerge0.1000.0510.806
Rmeas0.1090.0560.921
Rpim0.0440.0230.434
Number of reflections6888672836426
<I/σ(I)>11.7
Completeness [%]99.199.693.9
Redundancy65.53.9
CC(1/2)0.9970.695
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.42890.1 M sodium citrate pH 4.4 and 30% (w/v) PEG 1000

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