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MolNFT v1 · #118209 · protein

Rat prestin stas domain in complex with iodide

5EUZ · PRESTIN,PRESTIN: “Rat prestin stas domain in complex with iodide”. X-ray diffraction, 1 ligand (IOD), 3 pockets (best druggability 0.61). MolNFT v1 #118209 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5EUZ
Type
protein
Length
130 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PRESTIN,PRESTIN
UniProt
Q9EPH0
Ligands
IOD
Pockets
3 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APRESTIN,PRESTINprotein13035% helix, 22% strandQ9EPH0

Ligands and binding sites

  • IOD · Iodide ion · ion · 4 copies · chains A
  • EDO · 1,2-ethanediol · additive · 5 copies · chains A
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A
  • PGE · Triethylene glycol · additive · 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
1670.610.9014empty
2510.390.8114IOD
3640.290.7413IOD, PGE

Modifications

Observed in the structure: 1 modified (engineered).

Compared structures

  • 5EUZ · Rat prestin STAS domain in complex with iodide · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9EPH0 · AlphaFold monomer V2.0 prediction for prestin (Q9EPH0) · a predicted model of the same protein · chain A against A, TM-score 0.92

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