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Ligand · 0VA

0VA · N-[N-(4-amino-3,5-dichlorobenzyl)carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-thiazole-4-carboxamide

0VA, N-[N-(4-amino-3,5-dichlorobenzyl)carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-1,2-thiazole-4-carboxamide (C20 H19 Cl2 N5 O2 S, 464.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
0VA
Formula
C20 H19 Cl2 N5 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0VA in 2 structures; the first of them:

  • 4FSE · crystal structure of beta-site app-cleaving enzyme 1 (bace-wt) complex with… · 0VA A501 · binds LEU78, ASP80, GLY82, TYR119, THR120, GLN121, GLY122, LYS123 and 14 more
  • 4FSE · Crystal structure of beta-site app-cleaving enzyme 1 (bace-wt) complex with… · 0VA A501 · binds LEU78, ASP80, GLY82, TYR119, THR120, GLN121, GLY122, LYS123 and 14 more

Residues it binds most

GLY 8, ILE 8, THR 8, LYS 8, ASP 8, TYR 8, ARG 8, GLN 8, LEU 8, PHE 8 (residue and the binding sites it lines).

Found with

  • IOD · Iodide ion

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