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Structure of the CEACAM6-CEACAM8 heterodimer

Analyse Structure of the CEACAM6-CEACAM8 heterodimer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4YIQ
Type
protein
Length
429 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Carcinoembryonic antigen-related cell adhesion molecule 8; Carcinoembryonic…
UniProt
P31997, P40199
Ligands
CL
Pockets
2 · best druggability 0.67

Structure

x-ray diffraction · 3 distinct chains · 6% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CCarcinoembryonic antigen-related cell adhesion molecule 8protein1076% helix, 50% strandP31997
BCarcinoembryonic antigen-related cell adhesion molecule 6protein1076% helix, 51% strandP40199
DCarcinoembryonic antigen-related cell adhesion molecule 6protein1086% helix, 51% strandP40199

Ligands and binding sites

  • CL · Chloride ion · ion · chains B
  • GOL · Glycerol · additive · chains B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15030.670.7858empty
21530.430.7523empty

Interfaces

4 interfaces between chains.

  • C–D · 749 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 740 Ų buried · 8 hydrogen bonds · protein-protein
  • C–B · 334 Ų buried · 1 hydrogen bond · protein-protein
  • A–C · 112 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4YIQ · Structure of the CEACAM6-CEACAM8 heterodimer · the same entry in another collection · chain D against D, TM-score 1.00
  • P31997 · AlphaFold monomer V2.0 prediction for carcinoembryonic antigen- related cell adhesion… · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P40199 · AlphaFold monomer V2.0 prediction for carcinoembryonic antigen- related cell adhesion… · a predicted model of the same protein · chain B against A, TM-score 0.99

Analyse

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