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3WOO

Crystal structure of the DAP BII hexapeptide complex I

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-17A
Synchrotron sitePhoton Factory
BeamlineBL-17A
Detector technologyCCD
Collection date2013-02-17
DetectorADSC QUANTUM 270
Wavelength(s)0.98000
Spacegroup nameP 43 21 2
Unit cell lengths121.700, 121.700, 218.970
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution39.920 - 1.800
R-factor0.18441
Rwork0.182
R-free0.22436
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3woi
RMSD bond length0.019
RMSD bond angle1.881
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 Overall
Low resolution limit [Å]40.000
High resolution limit [Å]1.800
Number of reflections143581
Completeness [%]99.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP9.529318% PEG 8000, 20% Glycerol, 2mM ZnCl2, 80mM CHES, 2mM Angiotensin II, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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