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Ligand · X18

X18 · N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]-3-[(2R)-3,3-dimethylbutan-2-yl]-2-oxo-2,3-dihydro-1H-benzimidazole-5-carboxamide

X18, N-[(1S)-1-(5-bromopyridin-2-yl)ethyl]-3-[(2R)-3,3-dimethylbutan-2-yl]-2-oxo-2,3-dihydro-1H-benzimidazole-5-carboxamide (C21 H25 Br N4 O2, 445.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component
X18
Formula
C21 H25 Br N4 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

X18 in 1 structure; the first of them:

  • 8SZ3 · Structure of human beta 1,3-N-acetylglucosaminyltransferase 2 with compound 7j · X18 A401 · binds ARG115, LYS149, SER150, LEU151, HIS154, ARG157, ASP215, THR216 and 7 more

Residues it binds most

ASP 2, LYS 2, ARG 2, LEU 2, HIS 2, PHE 2, SER 2, THR 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • EDO · 1,2-ethanediol

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