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5GL8

The crystal structure of Nattokinase fragments

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]77
Detector technologyCCD
Collection date2016-06-02
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.987
Spacegroup nameP 1 21 1
Unit cell lengths52.284, 73.959, 67.811
Unit cell angles90.00, 97.47, 90.00
Refinement procedure
Resolution50.000 - 1.800
R-factor0.23363
Rwork0.231
R-free0.29053
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4dww
RMSD bond length0.020
RMSD bond angle1.935
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0049)
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]1.770
Number of reflections49947
<I/σ(I)>12.4
Completeness [%]99.6
Redundancy7.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.12880.1M HEPES ,0.8 M Potassium sodium tartrate tetrahydrate

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