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Ligand · GR4

GR4 · R3-acetoxy-17-(1-formyl-5-methyl-3-oxo-hex-4-enyl)-12,16-dihydroxy-14-hydroxymethyl-4,10,13-trimethyl-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-4-carboxylic acid idopyranosyl ester

GR4, R3-acetoxy-17-(1-formyl-5-methyl-3-oxo-hex-4-enyl)-12,16-dihydroxy-14-hydroxymethyl-4,10,13-trimethyl-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-4-carboxylic acid idopyranosyl ester (C38 H56 O14…

Component
GR4
Formula
C38 H56 O14
Class
ligand
Structures
2
PDB entries
1

Binding sites

GR4 in 2 structures; the first of them:

  • 1AWF · Novel covalent thrombin inhibitor from plant extract · GR4 H1 · binds HIS57, TYR60A, TRP60D, LEU99, TRP148, THR149, ASP189, ALA190 and 13 more
  • 1AWF · Novel covalent thrombin inhibitor from plant extract · GR4 H1 · binds HIS57, TYR60A, TRP60D, LEU99, TRP148, THR149, ASP189, ALA190 and 13 more

Residues it binds most

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

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