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Structure of the fibrinogen G chain integrin binding and factor xiiia crosslinking sites obtained through carrier protein driven crystallization

Analyse Structure of the fibrinogen G chain integrin binding and factor xiiia… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1DUG
Type
protein
Length
468 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chimera of glutathione S-transferase-synthetic linker-C- terminal fibrinogen gamma chain
EC
2.5.1.18
UniProt
P08515, P02679
Ligands
GSH
Pockets
2 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BChimera of glutathione S-transferase-synthetic linker-C- terminal fibrinogen gamma chain (EC 2.5.1.18)protein23448% helix, 8% strandP08515, P02679

Ligands and binding sites

  • GSH · Glutathione · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111940.800.81100GSH
2680.600.9025empty

Interfaces

1 interface between chains.

  • A–B · 1491 Ų buried · 25 hydrogen bonds · protein-protein

Compared structures

  • 1DUG · Structure of the fibrinogen G chain integrin binding and factor xiiia crosslinking sites… · the same entry in another collection · chain A against A, TM-score 1.00
  • P08515 · AlphaFold monomer V2.0 prediction for glutathione S-transferase class-mu 26 kda isozyme… · a predicted model of the same protein · chain A against A, TM-score 0.92
  • P02679 · AlphaFold monomer V2.0 prediction for fibrinogen gamma chain (P02679) · a predicted model of the same protein · chain A against A, TM-score 0.30

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