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Ligand · T12

T12 · 1-(3-hydroxypropyl)-2-[(3-nitrobenzoyl)amino]-1H-benzimidazol-5-yl pivalate

T12, 1-(3-hydroxypropyl)-2-[(3-nitrobenzoyl)amino]-1H-benzimidazol-5-yl pivalate (C22 H24 N4 O6, 440.4 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
T12
Formula
C22 H24 N4 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

T12 in 2 structures; the first of them:

  • 2NRU · Crystal structure of IRAK-4 · T12 A600 · binds MET192, GLY193, VAL200, ALA211, LYS213, VAL246, TYR262, VAL263 and 11 more
  • 2NRU · Crystal structure of irak-4 · T12 A600 · binds MET192, GLY193, VAL200, ALA211, LYS213, VAL246, TYR262, VAL263 and 11 more

Residues it binds most

VAL 8, ASP 8, GLY 8, MET 8, SER 8, TYR 8, ALA 8, ARG 8, ASN 8, LEU 8 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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