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Ligand · GR1

GR1 · 6-carbamimidoyl-2-[5-(3-diethylcarbamoyl-phenyl)-2-hydroxy-indan-1-yl]-hexanoic acid

GR1, 6-carbamimidoyl-2-[5-(3-diethylcarbamoyl-phenyl)-2-hydroxy-indan-1-yl]-hexanoic acid (C27 H35 N3 O4, 465.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
GR1
Formula
C27 H35 N3 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

GR1 in 2 structures; the first of them:

  • 1QJ7 · Novel Covalent Active Site Thrombin Inhibitors · GR1 B1248 · binds HIS57, TYR60A, TRP60D, TRP96, ARG97, GLU97A, ASN98, LEU99 and 17 more
  • 1QJ7 · Novel covalent active site thrombin inhibitors · GR1 B1248 · binds HIS57, TYR60A, TRP60D, TRP96, ARG97, GLU97A, ASN98, LEU99 and 17 more

Residues it binds most

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

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