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MolNFT v1 · #173757 · protein

Cys-42-tethered stabilizer 6 of 14-3-3(SIGMA)/ERA ppi

7BA3: “Cys-42-tethered stabilizer 6 of 14-3-3(SIGMA)/ERA ppi”. X-ray diffraction, 2 ligands (T5N, MG). MolNFT v1 #173757 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7BA3
Type
protein
Length
242 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P31947, P03372
Ligands
T5N, MG

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein236—P31947
B—protein6—P03372

Ligands and binding sites

  • T5N · 2-(4-bromanylphenoxy)-2-methyl-~{N}-(2-sulfanylethyl) propanamide · ligand · chains A, B
  • MG · Magnesium ion · metal · 3 copies · chains A

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

Compared structures

  • 7BA3 · Cys-42-tethered stabilizer 6 of 14-3-3(sigma)/ERa PPI · 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 0.58

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