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MolNFT v1 · #122836 · protein

Structure of the spectrin repeats 7 and 8 of the plakin domain of plectin

5J1G: “Structure of the spectrin repeats 7 and 8 of the plakin domain of plectin”. X-ray diffraction, 2 pockets (best druggability 0.72). MolNFT v1 #122836 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5J1G
Type
protein
Length
457 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Plectin
UniProt
Q15149
Pockets
2 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 85% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APlectinprotein22885% helix, 0% strandQ15149
BPlectinprotein22986% helix, 0% strandQ15149

Ligands and binding sites

  • 1PE · Pentaethylene glycol · additive · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · chains 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
16230.720.8060empty
23080.520.7433empty

Interfaces

1 interface between chains.

  • A–B · 617 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 5J1G · Structure of the spectrin repeats 7 and 8 of the plakin domain of plectin · the same entry in another collection · chain A against A, TM-score 1.00

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