1COV

COXSACKIEVIRUS B3 COAT PROTEIN


Experimental Data Snapshot

  • Method: X-RAY DIFFRACTION
  • Resolution: 3.50 Å
  • R-Value Work: 0.264 
  • R-Value Observed: 0.264 

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Literature

Structure determination of coxsackievirus B3 to 3.5 A resolution.

Muckelbauer, J.K.Kremer, M.Minor, I.Tong, L.Zlotnick, A.Johnson, J.E.Rossmann, M.G.

(1995) Acta Crystallogr D Biol Crystallogr 51: 871-887

  • DOI: https://doi.org/10.1107/S0907444995002253
  • Primary Citation of Related Structures:  
    1COV

  • PubMed Abstract: 

    The crystal structure of coxsackievirus B3 (CVB3) has been determined to 3.5 A resolution. The icosahedral CVB3 particles crystallize in the monoclinic space group, P2(1), (a = 574.6, b = 302.1, c = 521.6 A, beta = 107.7 degrees ) with two virions in the asymmetric unit giving 120-fold non-crystallographic redundancy. The crystals diffracted to 2.7 A resolution and the X-ray data set was 55% complete to 3.0,4, resolution. Systematically weak reflections and the self-rotation function established pseudo R32 symmetry with each particle sitting on a 32 special position. This constrained the orientation and position of each particle in the monoclinic cell to near face-centered positions and allowed for a total of six possible monoclinic space-group settings. Correct interpretation of the high-resolution (3.0-3.2 A) self-rotation function was instrumental in determining the deviations from R32 orientations of the virus particles in the unit cell. Accurate particle orientations permitted the correct assignment of the crystal space-group setting amongst the six ambiguous possibilities and for the correct determination of particle positions. Real-space electron-density averaging and phase refinement, using human rhinovius 14 (HRV14) as an initial phasing model, have been carried out to 3.5 A resolution. The initial structural model has been built and refined to 3.5 A resolution using X-PLOR.


  • Organizational Affiliation

    Department of Biological Sciences, Purdue University, West Lafayette, IN 47907, USA.


Macromolecules
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Entity ID: 1
MoleculeChains Sequence LengthOrganismDetailsImage
COXSACKIEVIRUS COAT PROTEINA [auth 1]281Coxsackievirus B3Mutation(s): 0 
UniProt
Find proteins for Q66282 (Coxsackievirus B3 (strain Woodruff))
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Go to UniProtKB:  Q66282
Entity Groups  
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UniProt GroupQ66282
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  • Reference Sequence
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Entity ID: 2
MoleculeChains Sequence LengthOrganismDetailsImage
COXSACKIEVIRUS COAT PROTEINB [auth 2]263Coxsackievirus B3Mutation(s): 0 
UniProt
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Go to UniProtKB:  Q66282
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Entity ID: 3
MoleculeChains Sequence LengthOrganismDetailsImage
COXSACKIEVIRUS COAT PROTEINC [auth 3]238Coxsackievirus B3Mutation(s): 0 
UniProt
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Go to UniProtKB:  Q66282
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  • Reference Sequence
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Entity ID: 4
MoleculeChains Sequence LengthOrganismDetailsImage
COXSACKIEVIRUS COAT PROTEIND [auth 4]68Coxsackievirus B3Mutation(s): 0 
UniProt
Find proteins for Q66282 (Coxsackievirus B3 (strain Woodruff))
Explore Q66282 
Go to UniProtKB:  Q66282
Entity Groups  
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UniProt GroupQ66282
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  • Reference Sequence
Small Molecules
Experimental Data & Validation

Experimental Data

  • Method: X-RAY DIFFRACTION
  • Resolution: 3.50 Å
  • R-Value Work: 0.264 
  • R-Value Observed: 0.264 
  • Space Group: P 1 21 1
Unit Cell:
Length ( Å )Angle ( ˚ )
a = 574.62α = 90
b = 302.07β = 107.7
c = 521.61γ = 90
Software Package:
Software NamePurpose
X-PLORmodel building
X-PLORrefinement
X-PLORphasing

Structure Validation

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Entry History 

Deposition Data

Revision History  (Full details and data files)

  • Version 1.0: 1996-03-08
    Type: Initial release
  • Version 1.1: 2008-03-24
    Changes: Version format compliance
  • Version 1.2: 2011-07-13
    Changes: Version format compliance
  • Version 1.3: 2011-08-10
    Changes: Advisory
  • Version 2.0: 2023-04-19
    Type: Remediation
    Changes: Advisory, Atomic model, Data collection, Database references, Derived calculations, Other, Refinement description