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Ligand · T1H

T1H · 2-[4-[[(~{E})-~{N},~{N}'-dimethylcarbamimidoyl]amino]piperidin-1-yl]-~{N}-[[2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazol-5-yl]methyl]ethanamide

T1H, 2-[4-[[(~{E})-~{N},~{N}'-dimethylcarbamimidoyl]amino]piperidin-1-yl]-~{N}-[[2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazol-5-yl]methyl]ethanamide (C21 H30 N10 O, 438.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
T1H
Formula
C21 H30 N10 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

T1H in 2 structures; the first of them:

  • 7B7I · BAZ2A bromodomain in complex with triazole compound MS04-TN02 · T1H A1901 · binds ASP1813, TRP1816, PRO1817, PHE1818, VAL1822, LEU1826, VAL1827, TYR1830 and 3 more
  • 7B7I · BAZ2A bromodomain in complex with triazole compound MS04-TN02 · T1H A1901 · binds TRP1816, PRO1817, VAL1822, LEU1826, VAL1827, TYR1830, ASN1873, VAL1879

Residues it binds most

VAL 2, ASN 2, LEU 2, PHE 1, PRO 2, TRP 2, TYR 2, ASP 1 (residue and the binding sites it lines).

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