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Crystal structure of gasdalie IGG1 Fc in complex with fcgriiia

Analyse Crystal structure of gasdalie IGG1 Fc in complex with fcgriiia in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5D6D
Type
protein
Length
574 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ig gamma-1 chain C region; Low affinity immunoglobulin gamma Fc region receptor III-a
UniProt
P01857, P08637
Ligands
NAG, MAN, BMA, GAL, FUL, FUC
Pockets
3 · best druggability 0.52

Structure

x-ray diffraction · 3 distinct chains · 9% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIg gamma-1 chain C regionprotein20911% helix, 46% strandP01857
BIg gamma-1 chain C regionprotein2089% helix, 44% strandP01857
CLow affinity immunoglobulin gamma Fc region receptor III-aprotein1576% helix, 49% strandP08637

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 10 copies · chains A, C, B
  • MAN · alpha-D-mannopyranose · sugar · 4 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar · 2 copies · chains A, B
  • GAL · beta-D-galactopyranose · sugar · 2 copies · chains A, B
  • FUL · beta-L-fucopyranose · sugar · chains A
  • FUC · alpha-L-fucopyranose · sugar · chains 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1530.520.8816empty
2570.300.7616empty
3580.270.7415empty

Interfaces

3 interfaces between chains.

  • A–B · 1145 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 442 Ų buried · 5 hydrogen bonds · protein-protein
  • B–C · 357 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide, 4 glycan (disulfide, N-glycosylation).

Compared structures

  • 5D6D · Crystal structure of GASDALIE IgG1 Fc in complex with FcgRIIIa · the same entry in another collection · chain A against A, TM-score 1.00
  • P08637 · AlphaFold monomer V2.0 prediction for low affinity immunoglobulin gamma Fc region… · a predicted model of the same protein · chain C against A, TM-score 0.98

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