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1LLN

1.6A CRYSTAL STRUCTURE OF POKEWEED ANTIVIRAL PROTEIN-III (PAP-III) WITH METHYLATED LYSINES

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL7-1
Synchrotron siteSSRL
BeamlineBL7-1
Temperature [K]90
Detector technologyIMAGE PLATE
Collection date2001-03-08
DetectorMARRESEARCH
Wavelength(s)0.97
Spacegroup nameP 31 2 1
Unit cell lengths80.470, 80.470, 76.210
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution7.000 - 1.600
R-factor0.203
Rwork0.201
R-free0.24500
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle1.170

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.660
High resolution limit [Å]1.6001.600
Rmerge0.0520.132
Number of reflections37018
<I/σ(I)>23.9
Completeness [%]97.396.9
Redundancy4.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5

*

4

*

30% PEG400, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 290K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21reservoirsodium borate0.2 (M)pH8.5

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