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Thorarchaeota rab GTP-gamma-S/MG2+ (soak)

Analyse Thorarchaeota rab GTP-gamma-S/MG2+ (soak) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7EZE
Type
protein
Length
342 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Thorarchaeota rab
UniProt
A0A135VL07
Ligands
GSP, MG
Pockets
3 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AThorarchaeota rabprotein17042% helix, 25% strandA0A135VL07
BThorarchaeota rabprotein17237% helix, 26% strandA0A135VL07

Ligands and binding sites

  • GSP · 5'-guanosine-diphosphate-monothiophosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12900.670.8233empty
21770.460.7520empty
3650.340.7620GSP

Interfaces

1 interface between chains.

  • A–B · 1321 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 7EZE · Thorarchaeota Rab GTP-gamma-S/Mg2+ (soak) · the same entry in another collection · chain A against A, TM-score 1.00

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