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MolNFT v1 · #101813 · protein

Structure of mus musculus rheb G63V mutant bound to GDP

4O2R · GTP-binding protein rheb: “Structure of mus musculus rheb G63V mutant bound to GDP”. X-ray diffraction, 2 ligands (GDP, MG), 5 pockets (best druggability 0.52). MolNFT v1 #101813 on GenesisL1: 3D structure, binding sites and pockets…

PDB
4O2R
Type
protein
Length
334 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
GTP-binding protein rheb
UniProt
Q921J2
Ligands
GDP, MG
Pockets
5 · best druggability 0.52

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGTP-binding protein rhebprotein16732% helix, 26% strandQ921J2

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12710.520.7541empty
21290.490.8029GDP, MG
31200.470.7926GDP, MG
4790.340.7619empty
5590.340.7717empty

Interfaces

1 interface between chains.

  • A–B · 415 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 4O2R · Structure of Mus musculus Rheb G63V mutant bound to GDP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q921J2 · AlphaFold monomer V2.0 prediction for GTP-binding protein rheb (Q921J2) · a predicted model of the same protein · chain A against A, TM-score 0.96

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