MolNFT v1 · #149171 · protein

Mus musculus acetylcholinesterase in complex with 1-(4-(4- ethylpiperazin-1-YL)PIPERIDIN-1-yl)-2-((4'-methoxy-[1,1'-biphenyl]-4- YL)OXY)ETHANONE dihydrochloride (15)

6FSE: “Mus musculus acetylcholinesterase in complex with 1-(4-(4…”. X-ray diffraction, 2 ligands (E5K, 1PG). MolNFT v1 #149171 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6FSE
Type: protein
Length: 1,068 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt: P21836
Ligands: E5K, 1PG

Structure

x-ray diffraction · 2 distinct chains.

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	—	protein	535	—	P21836
B	—	protein	533	—	P21836

Ligands and binding sites

E5K · 1-[4-(4-ethylpiperazin-1-yl)piperidin-1-yl]-2-[4-(4-methoxyphenyl)phenoxy]ethanone · ligand · 2 copies · chains A, B
1PG · 2-(2-{2-[2-(2-methoxy-ethoxy)-ethoxy]-ethoxy}-ethoxy)-ethanol · ligand · chains A, B
PG0 · 2-(2-methoxyethoxy)ethanol · additive · 3 copies · chains A, B
PEG · Di(hydroxyethyl)ether · additive · chains A

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

Compared structures

6FSE · Mus musculus acetylcholinesterase in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
P21836 · AlphaFold monomer V2.0 prediction for acetylcholinesterase (P21836) · a predicted model of the same protein · chain B against A, TM-score 1.00

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 P21836
Elsewhere: RCSB PDB 6FSE · PDBe 6FSE · UniProt P21836

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