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MolNFT v1 · #169925 · protein

Integrative in situ structure of parkinsons disease-linked human LRRK2

6XR4 · Leucine-rich repeat SERINE/THREONINE-protein kinase 2: “Integrative in situ structure of parkinsons disease-linked human LRRK2”. Electron microscopy, 3 pockets (best druggability 0.31). MolNFT v1 #169925 on GenesisL1: 3D structure…

PDB
6XR4
Type
protein
Length
2,080 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Leucine-rich repeat SERINE/THREONINE-protein kinase 2
EC
2.7.11.1, 3.6.5.-
UniProt
Q5S007
Pockets
3 · best druggability 0.31

Structure

electron microscopy · 1 distinct chain · 0% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BLeucine-rich repeat SERINE/THREONINE-protein kinase 2 (EC 2.7.11.1, 3.6.5.-)protein10400% helix, 0% strandQ5S007

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1680.310.7224empty
2640.300.7221empty
3590.290.7224empty

Interfaces

1 interface between chains.

  • A–B · 33 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 6XR4 · Integrative in situ structure of Parkinsons disease-linked human LRRK2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q5S007 · AlphaFold monomer V2.0 prediction for leucine-rich repeat SERINE/THREONINE-protein kinase… · a predicted model of the same protein · chain A against A, TM-score 0.75

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