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Crystal structure of the light-driven sodium pump KR2 in neutral state

Analyse Crystal structure of the light-driven sodium pump KR2 in neutral state in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3X3C
Type
protein
Length
271 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.3
Source
Dokdonia eikasta
Molecule
Sodium pumping rhodopsin
UniProt
N0DKS8
Ligands
OLA, RET
Pockets
1 · best druggability 0.76

Structure

x-ray diffraction · resolution 2.3 · 1 distinct chain · 76% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASodium pumping rhodopsinprotein27176% helix, 3% strandN0DKS8

Ligands and binding sites

  • OLA · Oleic acid · ligand · 3 copies · chains A
  • RET · Retinal · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11380.760.9426RET

Modifications

Observed in the structure: 1 cofactor (retinal Schiff base).

Compared structures

  • 3X3C · Crystal structure of the light-driven sodium pump KR2 in neutral state · the same entry in another collection · chain A against A, TM-score 1.00

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