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MolNFT v1 · #149003 · protein

Mono- and bivalent 14-3-3 inhibitors for characterizing supramolecular lysine-peg interactions in proteins

6FN9: “Mono- and bivalent 14-3-3 inhibitors for characterizing supramolecular lysine-peg interactions in proteins”. X-ray diffraction, 2 ligands (DW8, BEZ). MolNFT v1 #149003 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6FN9
Type
protein
Length
452 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P63104
Ligands
DW8, BEZ

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein228—P63104
B—protein224—P63104

Ligands and binding sites

  • DW8 · [2-[2-oxidanylidene-2-[[3-[2-[2-[2-[3-oxidanylidene-3-(propylamino) propoxy]ethoxy]ethoxy]ethylcarbamoyl]phenyl]amino]etho xy]phenyl]phosphonic acid · ligand · 2 copies · chains A, B
  • BEZ · Benzoic acid · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · 2 copies · chains A, B

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

Compared structures

  • 6FN9 · Mono- and bivalent 14-3-3 inhibitors for characterizing supramolecular lysine-PEG… · the same entry in another collection · chain A against A, TM-score 1.00
  • P63104 · AlphaFold monomer V2.0 prediction for 14-3-3 protein ZETA/DELTA (P63104) · a predicted model of the same protein · chain B against A, TM-score 0.99

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