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RCSB PDB - 6CPV: MicroED structure of NaK ion channel reveals a process of Na+ partition into the selectivity filter

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 6CPV | pdb_00006cpv

MicroED structure of NaK ion channel reveals a process of Na+ partition into the selectivity filter




    This is version 1.2 of the entry. See complete history



    MicroED structure of the NaK ion channel reveals a Na+partition process into the selectivity filter.

    Liu, S.Gonen, T.

    (2018) Commun Biol 1: 38-38

    • PubMed30167468 Search on PubMedSearch on PubMed Central
    • DOI: https://doi.org/10.1038/s42003-018-0040-8

    • PubMed Abstract: 

      Sodium (Na + ) is a ubiquitous and important inorganic salt mediating many critical biological processes such as neuronal excitation, signaling, and facilitation of various transporters. The hydration states of Na + are proposed to play critical roles in determining the conductance and the selectivity of Na + channels, yet they are rarely captured by conventional structural biology means. Here we use the emerging cryo-electron microscopy (cryoEM) method micro-electron diffraction (MicroED) to study the structure of a prototypical tetrameric Na + -conducting channel, NaK, to 2.5 Å resolution from nano-crystals. Two new conformations at the external site of NaK are identified, allowing us to visualize a partially hydrated Na + ion at the entrance of the channel pore. A process of dilation coupled with Na + movement is identified leading to valuable insights into the mechanism of ion conduction and gating. This study lays the ground work for future studies using MicroED in membrane protein biophysics.


    • Organizational Affiliation

      Janelia Research Campus, Howard Hughes Medical Institute, 19700 Helix Drive, Ashburn, VA, 20147, USA.

    Macromolecule Content

    • Total Structure Weight: 21.81 kDa 
    • Atom Count: 1,494 
    • Modelled Residue Count: 187 
    • Deposited Residue Count: 192 
    • Unique protein chains: 1

    Find similar proteins by:

    (by identity cutoff)  |  3D Structure

    Ligands 2 Unique
    IDChains Name / Formula / InChI Key2D Diagram3D Interactions
    MPD
    Query on MPD

    Download Ideal Coordinates CCD File 
    K [auth A](4S)-2-METHYL-2,4-PENTANEDIOL
    C6 H14 O2
    SVTBMSDMJJWYQN-YFKPBYRVSA-N
    NA
    Query on NA

    Download Ideal Coordinates CCD File 

    C [auth A]
    D [auth A]
    E [auth A]
    F [auth A]
    G [auth A]

    C [auth A],
    D [auth A],
    E [auth A],
    F [auth A],
    G [auth A],
    H [auth A],
    I [auth A],
    J [auth A],
    L [auth B],
    M [auth B],
    N [auth B],
    O [auth B]

    SODIUM ION
    Na
    FKNQFGJONOIPTF-UHFFFAOYSA-N

    Experimental Data & Validation

    Experimental Data

    • Method: ELECTRON CRYSTALLOGRAPHY
    • Resolution: 2.50 Å
    • R-Value Free:  0.263 (Depositor) 
    • R-Value Work:  0.218 (Depositor) 
    • R-Value Observed: 0.221 (Depositor) 

    Unit Cell:

    Length ( Å )Angle ( ˚ )
    a = 68.072α = 90
    b = 68.072β = 90
    c = 89.3γ = 90

    Software Package:

    Software NamePurpose
    PHENIXrefinement
    Aimlessdata scaling
    iMOSFLMdata reduction
    PHASERphasing

    Entry History & Funding Information

    Deposition Data


    Funding OrganizationLocationGrant Number
    Howard Hughes Medical Institute (HHMI)United States1

    Revision History  (Full details and data files)

    • Version 1.0: 2018-09-12
      Type: Initial release
    • Version 1.1: 2019-11-20
      Changes: Author supporting evidence
    • Version 1.2: 2023-10-04
      Changes: Data collection, Database references, Derived calculations, Refinement description