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The mechanism of activation of the actin binding protein EHBP1 by RAB8 family members.

Analyse The mechanism of activation of the actin binding protein EHBP1 by RAB8 family… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ZSJ
Type
protein
Length
606 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RAS-related protein rab-8A; Eh domain-binding protein 1
UniProt
P61006, Q8NDI1
Ligands
GNP, MG
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 59% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARAS-related protein rab-8Aprotein17137% helix, 28% strandP61006
BRAS-related protein rab-8Aprotein17337% helix, 28% strandP61006
CEh domain-binding protein 1protein13088% helix, 0% strandQ8NDI1
DEh domain-binding protein 1protein13289% helix, 0% strandQ8NDI1

Ligands and binding sites

  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14810.700.8061GNP, MG
23610.660.8042GNP, MG
34500.620.7652empty
4540.300.7511empty
5570.290.7510empty

Interfaces

3 interfaces between chains.

  • B–D · 912 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 845 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 424 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6ZSJ · The mechanism of activation of the actin binding protein EHBP1 by Rab8 family members. · the same entry in another collection · chain D against D, TM-score 1.00
  • P61006 · AlphaFold monomer V2.0 prediction for RAS-related protein rab-8A (P61006) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q8NDI1 · AlphaFold monomer V2.0 prediction for eh domain-binding protein 1 (Q8NDI1) · a predicted model of the same protein · chain C against A, TM-score 0.86

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