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Crystal structure of the central region of bovine fibrinogen (E5 fragment) at 1.4 ångströms resolution

Analyse Crystal structure of the central region of bovine fibrinogen (E5 fragment) at… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1JY3
Type
protein
Length
283 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fibrinogen alpha chain; Fibrinogen beta chain; Fibrinogen gamma-B chain
UniProt
P02676, P12799
Pockets
3 · best druggability 0.71

Structure

x-ray diffraction · 4 distinct chains · 58% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
N, QFibrinogen alpha chainprotein4468% helix, 9% strand—
O, RFibrinogen beta chainprotein5153% helix, 12% strandP02676
PFibrinogen gamma-B chainprotein4650% helix, 17% strandP12799
SFibrinogen gamma-B chainprotein4762% helix, 6% strandP12799

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12590.710.8639empty
21030.400.7617empty
3660.280.7314empty

Interfaces

14 interfaces between chains.

  • Q–R · 902 Ų buried · 9 hydrogen bonds · protein-protein
  • N–O · 880 Ų buried · 10 hydrogen bonds · protein-protein
  • Q–S · 776 Ų buried · 9 hydrogen bonds · protein-protein
  • P–S · 764 Ų buried · 5 hydrogen bonds · protein-protein
  • O–P · 758 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 1JY3 · Crystal Structure of the Central Region of Bovine Fibrinogen (E5 Fragment) at 1.4… · the same entry in another collection · chain S against S, TM-score 1.00
  • P02676 · AlphaFold monomer V2.0 prediction for fibrinogen beta chain (P02676) · a predicted model of the same protein · chain O against A, TM-score 0.82
  • P12799 · AlphaFold monomer V2.0 prediction for fibrinogen gamma-B chain (P12799) · a predicted model of the same protein · chain S against A, TM-score 0.75

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