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MolNFT v1 · #42024 · protein

Solution structure of myirstoylated yeast ARF1 protein, GDP-bound

2K5U · ADP-ribosylation factor 1: “Solution structure of myirstoylated yeast ARF1 protein, GDP-bound”. Solution nmr, 2 ligands (MYR, GDP), 2 pockets (best druggability 0.72). MolNFT v1 #42024 on GenesisL1: 3D structure, binding sites and…

PDB
2K5U
Type
protein
Length
180 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ADP-ribosylation factor 1
UniProt
P11076
Ligands
MYR, GDP
Pockets
2 · best druggability 0.72

Structure

solution nmr · 1 distinct chain · 32% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AADP-ribosylation factor 1protein18032% helix, 22% strandP11076

Ligands and binding sites

  • MYR · Myristic acid · ligand · chains A
  • GDP · Guanosine-5'-diphosphate · ligand · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16770.720.7861MYR
21180.600.8524empty

Modifications

Observed in the structure: 1 lipid (myristoylation).

Compared structures

  • 2K5U · Solution structure of myirstoylated yeast ARF1 protein, GDP-bound · the same entry in another collection · chain A against A, TM-score 1.00
  • P11076 · AlphaFold monomer V2.0 prediction for ADP-ribosylation factor 1 (P11076) · a predicted model of the same protein · chain A against A, TM-score 0.75

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