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MolNFT v1 · #124571 · protein

The novel P300/CBP inhibitor a-485 uncovers a unique mechanism of action to target ar in castrate resistant prostate cancer

5KJ2: “The novel P300/CBP inhibitor a-485 uncovers a unique mechanism of action to target ar in castrate resistant…”. X-ray diffraction, 2 ligands (6TF, NA). MolNFT v1 #124571 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5KJ2
Type
protein
Length
323 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q09472
Ligands
6TF, NA

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein323—Q09472

Ligands and binding sites

  • 6TF · N-[(4-fluorophenyl)methyl]-2-{(1R)-5-[(methylcarbamoyl)amino]-2',4'-dioxo-2,3-dihydro-3'H-spiro[indene-1,5'-[1,3]oxazolidin]-3'-yl}-N-[(2S)-1,1, 1-trifluoropropan-2-yl]acetamide · ligand · chains A
  • NA · Sodium ion · metal · chains A

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

Compared structures

  • 5KJ2 · The novel p300/CBP inhibitor A-485 uncovers a unique mechanism of action to target AR in… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q09472 · AlphaFold monomer V2.0 prediction for histone acetyltransferase P300 (Q09472) · a predicted model of the same protein · chain A against A, TM-score 0.99

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