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MolNFT v1 · #186788 · protein

Crystal structure of human CEACAM1 with gfcc' and abed face

7RPP · Carcinoembryonic antigen-related cell adhesion molecule 1: “Crystal structure of human CEACAM1 with gfcc' and abed face”. X-ray diffraction, 1 pocket (best druggability 0.37). MolNFT v1 #186788 on GenesisL1: 3D structure, binding…

PDB
7RPP
Type
protein
Length
321 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Carcinoembryonic antigen-related cell adhesion molecule 1
UniProt
P13688
Pockets
1 · best druggability 0.37

Structure

x-ray diffraction · 1 distinct chain · 6% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CCarcinoembryonic antigen-related cell adhesion molecule 1protein1076% helix, 51% strandP13688

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11150.370.7419empty

Interfaces

3 interfaces between chains.

  • B–C · 873 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 512 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 31 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7RPP · Crystal structure of human CEACAM1 with GFCC' and ABED face · the same entry in another collection · chain A against A, TM-score 1.00
  • P13688 · 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

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