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MolNFT v1 · #127063 · protein

Bromodomain of human GCN5 with 4-bromo-2-methyl-5-(((3R,5R)-1-methyl- 5-phenylpiperidin-3-YL)AMINO)PYRIDAZIN-3(2H)-one

5MLJ: “Bromodomain of human GCN5 with 4-bromo-2-methyl-5-(((3R,5R)-1-methyl…”. X-ray diffraction, 1 ligand (9ST). MolNFT v1 #127063 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MLJ
Type
protein
Length
213 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q92830
Ligands
9ST

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein109—Q92830
B—protein104—Q92830

Ligands and binding sites

  • 9ST · 4-bromo-2-methyl-5-[[(3~{R},5~{R})-1-methyl-5-phenyl-piperidin-3-yl]amino]pyridazin-3-one · ligand · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B

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

Compared structures

  • 5MLJ · Bromodomain of Human GCN5 with 4-bromo-2-methyl-5-(((3R,5R)-1-methyl-5-phenylpiperidin-3-y… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q92830 · AlphaFold monomer V2.0 prediction for histone acetyltransferase KAT2A (Q92830) · a predicted model of the same protein · chain B against A, TM-score 0.99

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