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Estrogen related receptor-gamma ligand binding domain

Analyse Estrogen related receptor-gamma ligand binding domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2GP7
Type
protein
Length
897 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Estrogen-related receptor gamma
UniProt
P62508
Ligands
CA
Pockets
13 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 68% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, DEstrogen-related receptor gammaprotein22468% helix, 3% strandP62508
BEstrogen-related receptor gammaprotein22567% helix, 3% strandP62508

Ligands and binding sites

  • CA · Calcium ion · metal · chains A

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

Pockets

13 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111470.780.80109empty
2610.740.9816empty
35760.700.7956empty
41540.680.8834empty
54530.670.7953empty

Interfaces

6 interfaces between chains.

  • C–D · 1480 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 1417 Ų buried · 15 hydrogen bonds · protein-protein
  • B–C · 321 Ų buried · 2 hydrogen bonds · protein-protein
  • A–D · 321 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 108 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2GP7 · Estrogen Related Receptor-gamma ligand binding domain · the same entry in another collection · chain D against D, TM-score 1.00
  • P62508 · AlphaFold monomer V2.0 prediction for estrogen-related receptor gamma (P62508) · a predicted model of the same protein · chain C against A, TM-score 0.99

Analyse

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