MolNFT v2 · #204191 · protein

Small molecule stabilizer for ERalpha and 14-3-3 (1074210)

8AXE: “Small molecule stabilizer for ERalpha and 14-3-3 (1074210)”. X-ray diffraction at 1.8, 2 ligands (ODC, MG). MolNFT v2 #204191 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 8AXE
Type: protein
Length: 241 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v2 / PDB Bank
Contract: 0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner: 0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution: 1.8
Source: Homo sapiens; SYNTHETIC CONSTRUCT
UniProt: P31947, P03372
Ligands: ODC, MG

Structure

x-ray diffraction · resolution 1.8 · 2 distinct chains.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	—	protein	236	—	P31947
B	—	protein	5	—	P03372

Ligands and binding sites

ODC · 2-chloranyl-~{N}-[2-[1-[2-(4-chloranylphenoxy)-2-methyl-propanoyl]piperidin-4-yl]ethyl]ethanamide · ligand · chains A, B
MG · Magnesium ion · metal · 2 copies · chains A

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

Compared structures

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 0.81

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt P31947
Every structure of UniProt P03372
Elsewhere: RCSB PDB 8AXE · PDBe 8AXE · UniProt P31947 · UniProt P03372

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