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4DIG

Crystal Structure of C-lobe of Bovine lactoferrin Complexed with N-acetylmuramyl l-alanyl d-isoglutamine at 1.8 A Resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM14
Synchrotron siteESRF
BeamlineBM14
Temperature [K]77
Detector technologyCCD
Collection date2011-11-09
DetectorMARRESEARCH
Wavelength(s)0.97
Spacegroup nameP 1 21 1
Unit cell lengths62.550, 49.951, 65.129
Unit cell angles90.00, 107.03, 90.00
Refinement procedure
Resolution62.270 - 1.800
R-factor0.1763
Rwork0.174
R-free0.21592
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ib0
RMSD bond length0.023
RMSD bond angle2.304
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]62.5001.830
High resolution limit [Å]1.8001.800
Number of reflections33656
<I/σ(I)>22.93.1
Completeness [%]98.599.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52980.01M Znso4, 0.1M MES, 25% PEG, Monomethyl Ether 550, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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