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MolNFT v1 · #144057 · protein

Mouse immunoglobulin G 2C Fc fragment with single glcnac

6BHY · Igh protein: “Mouse immunoglobulin G 2C Fc fragment with single glcnac”. X-ray diffraction, 2 ligands (NAG, NA), 3 pockets (best druggability 0.64). MolNFT v1 #144057 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6BHY
Type
protein
Length
416 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Igh protein
UniProt
Q58E56
Ligands
NAG, NA
Pockets
3 · best druggability 0.64

Structure

x-ray diffraction · 2 distinct chains · 12% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIgh proteinprotein20911% helix, 50% strandQ58E56
BIgh proteinprotein20712% helix, 50% strandQ58E56

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 copies · chains A, B
  • NA · Sodium ion · metal · 6 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15500.640.7656empty
22810.520.7540empty
3610.340.7720empty

Interfaces

1 interface between chains.

  • A–B · 403 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 4 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 6BHY · Mouse Immunoglobulin G 2c Fc fragment with single GlcNAc · the same entry in another collection · chain A against A, TM-score 1.00

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