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Crystal structure of the plectin 1A actin-binding DOMAIN/INTEGRIN beta 4 fragment complex

Analyse Crystal structure of the plectin 1A actin-binding DOMAIN/INTEGRIN beta 4… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4Q58
Type
protein
Length
825 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Plectin; Integrin beta-4
UniProt
Q15149, P16144
Pockets
10 · best druggability 0.68

Structure

x-ray diffraction · 4 distinct chains · 30% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APlectinprotein22555% helix, 0% strandQ15149
BPlectinprotein22357% helix, 0% strandQ15149
CIntegrin beta-4protein1830% helix, 44% strandP16144
DIntegrin beta-4protein1940% helix, 43% strandP16144

Pockets

10 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18120.680.75101empty
27030.660.7557empty
3630.540.8825empty
41420.510.7932empty
51940.500.7721empty

Interfaces

4 interfaces between chains.

  • C–D · 1411 Ų buried · 21 hydrogen bonds · protein-protein
  • A–D · 761 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 443 Ų buried · 1 hydrogen bond · protein-protein
  • B–C · 57 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 4Q58 · Crystal structure of the plectin 1a actin-binding domain/integrin beta 4 fragment complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P16144 · AlphaFold monomer V2.0 prediction for integrin beta-4 (P16144) · a predicted model of the same protein · chain C against A, TM-score 0.93

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