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5CRY

Structure of iron-saturated C-lobe of bovine lactoferrin at pH 6.8 indicates the softening of iron coordination

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM14
Synchrotron siteESRF
BeamlineBM14
Temperature [K]300
Detector technologyCCD
Collection date2014-12-22
DetectorMARRESEARCH
Wavelength(s)0.97
Spacegroup nameC 1 2 1
Unit cell lengths159.654, 82.580, 107.694
Unit cell angles90.00, 128.08, 90.00
Refinement procedure
Resolution39.450 - 2.790
R-factor0.20869
Rwork0.205
R-free0.27287
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4fjp
RMSD bond length0.018
RMSD bond angle1.852
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 Overall
Low resolution limit [Å]39.450
High resolution limit [Å]2.790
Number of reflections27307
<I/σ(I)>16
Completeness [%]99.2
Redundancy4.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.83000.05M HEPES, 20% PEG 20K

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