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Crystal structure of the rat androgen receptor ligand binding domain complex with dihydrotestosterone

Analyse Crystal structure of the rat androgen receptor ligand binding domain complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1I37
Type
protein
Length
246 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Androgen receptor
UniProt
P15207
Ligands
DHT
Pockets
2 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 65% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAndrogen receptorprotein24665% helix, 5% strandP15207

Ligands and binding sites

  • DHT · 5-alpha-dihydrotestosterone · 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
11530.830.9821DHT
21390.610.8526empty

Compared structures

  • 1I37 · Crystal structure of the rat androgen receptor ligand binding domain complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P15207 · AlphaFold monomer V2.0 prediction for androgen receptor (P15207) · a predicted model of the same protein · chain A against A, TM-score 0.98

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