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Ligand · T1B

T1B · 5-ethyl-2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazole

T1B, 5-ethyl-2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazole (C12 H13 N5, 227.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
T1B
Formula
C12 H13 N5
Class
ligand
Structures
4
PDB entries
2

Binding sites

T1B in 4 structures; the first of them:

  • 7B7B · BAZ2A bromodomain in complex with triazole compound MS04 · T1B A1901 · binds TRP1816, PRO1817, PHE1818, VAL1822, LEU1826, VAL1827, TYR1830, PHE1872 and 2 more
  • 7B7G · BAZ2A bromodomain in complex with compounds MS04 and B11 · T1B A1901 · binds TRP1816, PRO1817, PHE1818, VAL1822, LEU1826, VAL1827, TYR1830, PHE1872 and 2 more
  • 7B7B · BAZ2A bromodomain in complex with triazole compound MS04 · T1B A1901 · binds TRP1816, PRO1817, PHE1818, VAL1822, LEU1826, VAL1827, TYR1830, PHE1872 and 2 more
  • 7B7G · BAZ2A bromodomain in complex with compounds MS04 and B11 · T1B A1901 · binds TRP1816, PRO1817, PHE1818, VAL1822, LEU1826, VAL1827, TYR1830, PHE1872 and 2 more

Residues it binds most

VAL 4, PHE 4, ASN 4, LEU 4, PRO 4, TRP 4, TYR 4 (residue and the binding sites it lines).

Found with

  • T1E · 1-[1-(3,5-dimethoxyphenyl)piperidin-4-yl]-2,3-dimethyl-guanidine

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