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MolNFT v1 · #183135 · protein

Human 14-3-3 sigma in complex with human estrogen receptor alpha peptide

7NFW · 14-3-3 protein sigma: “Human 14-3-3 sigma in complex with human estrogen receptor alpha peptide”. X-ray diffraction, 2 pockets (best druggability 0.50). MolNFT v1 #183135 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7NFW
Type
protein
Length
236 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
14-3-3 protein sigma; Estrogen receptor
UniProt
P31947, P03372
Pockets
2 · best druggability 0.50

Structure

x-ray diffraction · 2 distinct chains · 80% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A14-3-3 protein sigmaprotein23181% helix, 0% strandP31947
BEstrogen receptorprotein50% helix, 0% strandP03372

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11270.500.8021empty
2620.340.7713empty

Interfaces

1 interface between chains.

  • A–B · 483 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 modified (phosphorylation).

Compared structures

  • 7NFW · Human 14-3-3 sigma in complex with human Estrogen Receptor alpha peptide · the same entry in another collection · chain A against A, TM-score 1.00
  • P31947 · AlphaFold monomer V2.0 prediction for 14-3-3 protein sigma (P31947) · a predicted model of the same protein · chain A against A, TM-score 0.95
  • P03372 · AlphaFold monomer V2.0 prediction for estrogen receptor (P03372) · a predicted model of the same protein · chain B against A, TM-score 0.90

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