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Glucocorticoid receptor bound to high cooperativity monomer sequence

Analyse Glucocorticoid receptor bound to high cooperativity monomer sequence in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6BSE
Type
protein + DNA
Length
177 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glucocorticoid receptor; DNA (5'- D(P*TP*AP*AP*AP*AP*AP*GP*TP*AP*CP*AP*CP*GP*TP*GP*G)-3')…
UniProt
P79269
Ligands
ZN
Pockets
2 · best druggability 0.68

Structure

x-ray diffraction · 4 distinct chains · 32% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlucocorticoid receptorprotein7330% helix, 11% strandP79269
BGlucocorticoid receptorprotein7233% helix, 11% strandP79269
CDNA (5'- D(P*TP*AP*AP*AP*AP*AP*GP*TP*AP*CP*AP*CP*GP*TP*GP*G)-3')dna16——
DDNA (5'- D(P*AP*CP*CP*AP*CP*GP*TP*GP*TP*AP*CP*TP*TP*TP*TP*T)-3')dna16——

Ligands and binding sites

  • ZN · Zinc ion · metal · 4 copies · chains A, B

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

Pockets

2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14800.680.7937empty
21030.360.7519empty

Interfaces

6 interfaces between chains.

  • C–D · 679 Ų buried · 62 hydrogen bonds · nucleic-nucleic
  • A–B · 613 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 384 Ų buried · 6 hydrogen bonds · protein-nucleic
  • A–C · 320 Ų buried · 5 hydrogen bonds · protein-nucleic
  • B–C · 284 Ų buried · 7 hydrogen bonds · protein-nucleic

Compared structures

  • 6BSE · Glucocorticoid receptor bound to high cooperativity monomer sequence · the same entry in another collection · chain A against A, TM-score 1.00
  • P79269 · AlphaFold monomer V2.0 prediction for glucocorticoid receptor (P79269) · a predicted model of the same protein · chain B against A, TM-score 0.96

Analyse

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