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Crystal structure of human claudin-9 in complex with clostridium perfringens entertoxin C-terminal domain in open form

Analyse Crystal structure of human claudin-9 in complex with clostridium perfringens… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6OV3
Type
protein
Length
302 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Claudin-9; Heat-labile enterotoxin B chain
UniProt
O95484, P01558
Pockets
2 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 34% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AClaudin-9protein17953% helix, 13% strandO95484
BHeat-labile enterotoxin B chainprotein1236% helix, 53% strandP01558

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16100.730.8151empty
2960.460.8029empty

Interfaces

1 interface between chains.

  • A–B · 1177 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6OV3 · Crystal structure of human claudin-9 in complex with Clostridium perfringens entertoxin… · the same entry in another collection · chain A against A, TM-score 1.00
  • P01558 · AlphaFold monomer V2.0 prediction for heat-labile enterotoxin B chain (P01558) · a predicted model of the same protein · chain B against A, TM-score 0.93
  • O95484 · AlphaFold monomer V2.0 prediction for claudin-9 (O95484) · a predicted model of the same protein · chain A against A, TM-score 0.93

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