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Ligand · RRR

RRR · 4-{[(E)-2-(5-chlorothien-2-yl)vinyl]sulfonyl}-1-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)piperazin-2-one

RRR, 4-{[(E)-2-(5-chlorothien-2-yl)vinyl]sulfonyl}-1-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)piperazin-2-one (C18 H17 Cl N4 O3 S2, 436.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
RRR
Formula
C18 H17 Cl N4 O3 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

RRR in 2 structures; the first of them:

  • 1NFW · Crystal structure of human coagulation factor xa complexed with RPR209685 · RRR A301 · binds GLU97, THR98, TYR99, PHE174, ASP189, ALA190, CYS191, GLN192 and 10 more
  • 1NFW · Crystal structure of human coagulation factor xa complexed with RPR209685 · RRR A301 · binds GLU97, THR98, TYR99, PHE174, ASP189, ALA190, CYS191, GLN192 and 10 more

Residues it binds most

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

Found with

  • CA · Calcium ion

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