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CDC42 binds PAK4 via an extended GTPase-effector inteface - 2 peptide: PAK4FL, CDC42 - unrefined

Analyse CDC42 binds PAK4 via an extended GTPase-effector inteface - 2 peptide: PAK4FL… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5UPL
Type
protein
Length
467 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SERINE/THREONINE-protein kinase pak 4; Cell division control protein 42 homolog
EC
2.7.11.1
UniProt
O96013, P60953
Pockets
6 · best druggability 0.64

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASERINE/THREONINE-protein kinase pak 4 (EC 2.7.11.1)protein29140% helix, 18% strandO96013
BCell division control protein 42 homologprotein17637% helix, 23% strandP60953

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15940.640.7554empty
22340.620.8133empty
31240.530.8115empty
4750.390.7816empty
5500.280.7512empty

Interfaces

1 interface between chains.

  • A–B · 246 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 modified (phosphorylation).

Compared structures

  • 5UPL · CDC42 binds PAK4 via an extended GTPase-effector inteface - 2 peptide: PAK4FL, CDC42… · the same entry in another collection · chain A against A, TM-score 1.00
  • P60953 · AlphaFold monomer V2.0 prediction for cell division control protein 42 homolog (P60953) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • O96013 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein kinase pak 4 (O96013) · a predicted model of the same protein · chain A against A, TM-score 0.99

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