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MolNFT v1 · #179681 · protein

Crystal structure of rhesus macaque (macaca mulatta) IGG1 Fc fragment- Fc-gamma receptor III complex V158 mutant

7KCZ: “Crystal structure of rhesus macaque (macaca mulatta) IGG1 Fc fragment- Fc-gamma receptor III complex V158…”. X-ray diffraction, 4 ligands (NAG, MAN, BMA), 11 pockets (best druggability 0.56). MolNFT v1 #179681 on GenesisL1: 3D…

PDB
7KCZ
Type
protein
Length
1,179 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
IGG1 Fc; Low affinity immunoglobulin gamma Fc region receptor III
UniProt
F6RL33, A3RFZ7
Ligands
NAG, MAN, BMA, FUC
Pockets
11 · best druggability 0.56

Structure

x-ray diffraction · 4 distinct chains · 6% helix, 40% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DIGG1 Fcprotein20910% helix, 45% strandF6RL33
B, EIGG1 Fcprotein21210% helix, 35% strandF6RL33
CLow affinity immunoglobulin gamma Fc region receptor IIIprotein1680% helix, 39% strandA3RFZ7
FLow affinity immunoglobulin gamma Fc region receptor IIIprotein1692% helix, 39% strandA3RFZ7

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 24 copies · chains A, C, B, D, F, E
  • MAN · alpha-D-mannopyranose · sugar · 9 copies · chains A, B, D, E
  • BMA · beta-D-mannopyranose · sugar · 6 copies · chains A, B, D, E
  • FUC · alpha-L-fucopyranose · sugar · 5 copies · chains B, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13000.560.7630empty
2770.440.8017empty
3630.350.7813empty
4590.330.7712empty
5780.320.7420empty

Interfaces

7 interfaces between chains.

  • D–E · 1242 Ų buried · 12 hydrogen bonds · protein-protein
  • A–B · 1155 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 543 Ų buried · 8 hydrogen bonds · protein-protein
  • D–F · 521 Ų buried · 3 hydrogen bonds · protein-protein
  • E–F · 339 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 12 disulfide, 10 glycan (disulfide, N-glycosylation).

Compared structures

  • 7KCZ · Crystal structure of rhesus macaque (macaca mulatta) IGG1 Fc fragment- Fc-gamma receptor… · the same entry in another collection · chain F against F, TM-score 1.00
  • A3RFZ7 · AlphaFold monomer V2.0 prediction for low affinity immunoglobulin gamma Fc region… · a predicted model of the same protein · chain F against A, TM-score 0.96

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