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Crystal structure of a mutant (P393GX) thyroid receptor alpha ligand binding domain designed to model dominant negative human mutations.

Analyse Crystal structure of a mutant (P393GX) thyroid receptor alpha ligand binding… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7QDT
Type
protein
Length
236 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Isoform alpha-1 of thyroid hormone receptor alpha
UniProt
P10827
Ligands
T3
Pockets
3 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 61% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIsoform alpha-1 of thyroid hormone receptor alphaprotein23661% helix, 6% strandP10827

Ligands and binding sites

  • T3 · 3,5,3'triiodothyronine · ligand · 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
12300.790.9239T3
21440.460.7721empty
3530.410.8216empty

Compared structures

  • 7QDT · Crystal structure of a mutant (P393GX) Thyroid Receptor Alpha ligand binding domain… · the same entry in another collection · chain A against A, TM-score 1.00
  • P10827 · AlphaFold monomer V2.0 prediction for thyroid hormone receptor alpha (P10827) · a predicted model of the same protein · chain A against A, TM-score 0.96

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