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Ligand · 411

411 · 3-bromo-N-[4-[1-(2-carbamimidamido-2-oxo-ethyl)-5-phenyl-pyrrol-2-yl]phenyl]benzamide

411, 3-bromo-N-[4-[1-(2-carbamimidamido-2-oxo-ethyl)-5-phenyl-pyrrol-2-yl]phenyl]benzamide (C26 H22 Br N5 O2, 516.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
411
Formula
C26 H22 Br N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

411 in 2 structures; the first of them:

  • 2ZE1 · X-ray structure of Bace-1 in complex with compound 6g · 411 A1 · binds GLN74, GLY75, LEU92, ASP94, GLY96, SER97, ASN99, VAL131 and 13 more
  • 2ZE1 · X-ray structure of bace-1 in complex with compound 6G · 411 A1 · binds GLN74, GLY75, LEU92, ASP94, GLY96, SER97, ASN99, VAL131 and 13 more

Residues it binds most

GLY 2, ASP 2, ILE 2, SER 2, THR 2, TRP 2, ALA 2, ARG 2, ASN 2, GLN 2 (residue and the binding sites it lines).

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