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MolNFT v1 · #152697 · protein

X-ray crystal structure of covalent-bonded complex of Fc and peptide

6IQH · Immunoglobulin gamma-1 heavy chain: “X-ray crystal structure of covalent-bonded complex of Fc and peptide”. X-ray diffraction, 5 ligands (GUA, NAG, MAN). MolNFT v1 #152697 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6IQH
Type
protein
Length
440 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Immunoglobulin gamma-1 heavy chain; 17-mer peptide (gpdcayhkgelvwctfh)
UniProt
P0DOX5
Ligands
GUA, NAG, MAN, BMA, FUC

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BImmunoglobulin gamma-1 heavy chainprotein20710% helix, 44% strandP0DOX5
C, D17-mer peptide (gpdcayhkgelvwctfh)protein130% helix, 69% strand—

Ligands and binding sites

  • GUA · Glutaric acid · ligand · 2 copies · chains A, C, B, D
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 8 copies · chains A, B
  • MAN · alpha-D-mannopyranose · sugar · 4 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar · 2 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · 2 copies · chains A

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

Interfaces

3 interfaces between chains.

  • A–B · 1181 Ų buried · 6 hydrogen bonds · protein-protein
  • B–D · 621 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 588 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide, 4 covalent, 2 glycan (disulfide, covalent ligand, N-glycosylation).

Compared structures

  • 6IQH · X-ray crystal structure of covalent-bonded complex of Fc and peptide · the same entry in another collection · chain A against A, TM-score 1.00

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