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MolNFT v1 · #98274 · protein

Crystal structure of Fc-fragment of human IGG2-sigma antibody

4L4J · Ig gamma-2 chain C region: “Crystal structure of Fc-fragment of human IGG2-sigma antibody”. X-ray diffraction, 4 ligands (NAG, MAN, BMA), 3 pockets (best druggability 0.48). MolNFT v1 #98274 on GenesisL1: 3D structure, binding sites…

PDB
4L4J
Type
protein
Length
390 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ig gamma-2 chain C region
UniProt
P01859
Ligands
NAG, MAN, BMA, FUC
Pockets
3 · best druggability 0.48

Structure

x-ray diffraction · 2 distinct chains · 12% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIg gamma-2 chain C regionprotein20811% helix, 49% strandP01859
BIg gamma-2 chain C regionprotein18213% helix, 49% strandP01859

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B
  • MAN · alpha-D-mannopyranose · sugar · 3 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar · 2 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · chains A
  • GOL · Glycerol · additive · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1510.480.8616empty
2590.280.7416empty
3730.280.7219empty

Interfaces

1 interface between chains.

  • A–B · 1158 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 4L4J · Crystal structure of fc-fragment of human IgG2-Sigma antibody · the same entry in another collection · chain A against A, TM-score 1.00
  • P01859 · AlphaFold monomer V2.0 prediction for immunoglobulin heavy constant gamma 2 (P01859) · a predicted model of the same protein · chain A against A, TM-score 0.94

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