GL1X · GenesisL1 explorer

MolNFT v1 · #127044 · protein

Bromodomain of mouse pcaf with (R)-4-chloro-2-methyl-5-((1- methylpiperidin-3-YL)AMINO)PYRIDAZIN-3(2H)-one

5ML0: “Bromodomain of mouse pcaf with (R)-4-chloro-2-methyl-5-((1- methylpiperidin-3-YL)AMINO)PYRIDAZIN-3(2H)-one”. X-ray diffraction, 1 ligand (P2L). MolNFT v1 #127044 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5ML0
Type
protein
Length
108 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9JHD1
Ligands
P2L

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein108—Q9JHD1

Ligands and binding sites

  • P2L · 4-chlorol-2-methyl-5-[[(3~{R})-1-methylpiperidin-3-yl]amino]pyridazin-3-one · ligand · chains A
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A

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

Compared structures

  • 5ML0 · Bromodomain of Mouse PCAF with (R)-4-chloro-2-methyl-5-((1-methylpiperidin-3-yl)amino)pyri… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9JHD1 · AlphaFold monomer V2.0 prediction for histone acetyltransferase KAT2B (Q9JHD1) · a predicted model of the same protein · chain A against A, TM-score 0.96

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