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Crystal structure of the agonist form of mouse glucocorticoid receptor stabilized by F608S mutation at 1.96A

Analyse Crystal structure of the agonist form of mouse glucocorticoid receptor… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MNE
Type
protein
Length
263 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glucocorticoid receptor; Nuclear receptor coactivator 2 peptide
UniProt
P06537, Q61026
Ligands
DEX
Pockets
2 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 66% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlucocorticoid receptorprotein25366% helix, 5% strandP06537
BNuclear receptor coactivator 2 peptideprotein1060% helix, 0% strandQ61026

Ligands and binding sites

  • DEX · Dexamethasone · ligand · chains A
  • GOL · Glycerol · additive · 2 copies · 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
11830.830.9723DEX
21360.670.8819GOL

Interfaces

1 interface between chains.

  • A–B · 549 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 3MNE · Crystal structure of the agonist form of mouse glucocorticoid receptor stabilized by… · the same entry in another collection · chain A against A, TM-score 1.00
  • P06537 · AlphaFold monomer V2.0 prediction for glucocorticoid receptor (P06537) · a predicted model of the same protein · chain A against A, TM-score 0.95
  • Q61026 · AlphaFold monomer V2.0 prediction for nuclear receptor coactivator 2 (Q61026) · a predicted model of the same protein · chain B against A, TM-score 0.81

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