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Ligand · UME

UME · N-ethyl-2-(1-methyl-1H-1,2,3-triazol-4-yl)-6-(1-phenylethyl)isonicotinamide

UME, N-ethyl-2-(1-methyl-1H-1,2,3-triazol-4-yl)-6-(1-phenylethyl)isonicotinamide (C19 H21 N5 O, 335.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
UME
Formula
C19 H21 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

UME in 2 structures; the first of them:

  • 7NQJ · C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH N-ethyl-2-(1-methyl-1H-1,2,3-triazol-4-yl)-6-(1… · UME A501 · binds TRP370, PRO371, PHE372, VAL376, LEU381, LEU383, CYS425, TYR428 and 6 more
  • 7NQJ · C-terminal bromodomain of human BRD2 with N-ethyl-2-(1-methyl-1H-1,2… · UME A501 · binds TRP370, PRO371, PHE372, VAL376, LEU381, LEU383, CYS425, TYR428 and 5 more

Residues it binds most

LEU 2, PRO 2, VAL 2, ASN 2, CYS 2, HIS 2, MET 2, PHE 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether

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