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Ligand · BZT

BZT · 3-(3-bromo-4-pyrrolidin-1-ylmethyl-benzyl)-2-[4-pyrrolidin-1-yl-ethoxy)-phenyl]-benzo[b]thiophen-6-ol

BZT, 3-(3-bromo-4-pyrrolidin-1-ylmethyl-benzyl)-2-[4-pyrrolidin-1-yl-ethoxy)-phenyl]-benzo[b]thiophen-6-ol (C32 H35 Br N2 O2 S, 591.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
BZT
Formula
C32 H35 Br N2 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

BZT in 2 structures; the first of them:

  • 1D3D · Crystal structure of human alpha thrombin in complex with benzothiophene inhibitor 4 · BZT B400 · binds HIS79, TYR83, TRP86, GLU130, LEU132, ILE215, ASP235, ALA236 and 13 more
  • 1D3D · Crystal structure of human alpha thrombin in complex with benzothiophene inhibitor 4 · BZT B400 · binds HIS79, TYR83, TRP86, GLU130, LEU132, ILE215, ASP235, ALA236 and 13 more

Residues it binds most

GLY 2, CYS 2, GLU 2, SER 2, TRP 2, TYR 2, ALA 2, ASP 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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