GL1X · GenesisL1 explorer

MolNFT v1 · #107286 · protein

Importin-alpha minor nls site inhibitor

4U5V · Importin subunit alpha-1: “Importin-alpha minor nls site inhibitor”. X-ray diffraction, 1 ligand (RH2), 1 pocket (best druggability 0.45). MolNFT v1 #107286 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4U5V
Type
protein
Length
426 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Importin subunit alpha-1
UniProt
P52293
Ligands
RH2
Pockets
1 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 73% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AImportin subunit alpha-1protein42673% helix, 0% strandP52293

Ligands and binding sites

  • RH2 · N~2~-{[5-(pyridin-3-yl)thiophen-2-yl]methyl}-L-lysinamide · ligand · 2 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1620.450.8213empty

Compared structures

  • 4U5V · Importin-alpha minor nls site inhibitor · the same entry in another collection · chain A against A, TM-score 1.00
  • P52293 · AlphaFold monomer V2.0 prediction for importin subunit alpha-1 (P52293) · a predicted model of the same protein · chain A against A, TM-score 0.99

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