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9QN4

Fe(II)-2-oxoglutarate-dependent pseudomonal iron uptake factor C in complex with 2-oxoglutarate (Fe)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2024-07-22
DetectorDECTRIS EIGER X 16M
Wavelength(s)0.97628
Spacegroup nameP 1
Unit cell lengths80.605, 80.113, 88.798
Unit cell angles63.12, 62.94, 59.76
Refinement procedure
Resolution44.000 - 1.850
R-factor0.2277
Rwork0.227
R-free0.24350
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.004
RMSD bond angle0.753
Data reduction softwareDIALS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX ((1.20.1_4487: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.0001.880
High resolution limit [Å]1.8501.850
Rmerge0.0580.585
Rmeas0.0790.827
Rpim0.0410.585
Number of reflections1326756592
<I/σ(I)>8.91.7
Completeness [%]95.095.7
Redundancy3.83.8
CC(1/2)0.9960.619
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP62900.1M succinic acid, sodium phosphate monobasic monohydrate, glycine (pH 6) 30% PEG 1000 2 mM FeCl2

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