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Ligand · RUP

RUP · (R)-2-(3-adamantan-1-yl-ureido)-3-(3-carbamimidoyl-phenyl)-N-phenethyl-propionamide

RUP, (R)-2-(3-adamantan-1-yl-ureido)-3-(3-carbamimidoyl-phenyl)-N-phenethyl-propionamide (C29 H37 N5 O2, 487.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
RUP
Formula
C29 H37 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

RUP in 2 structures; the first of them:

  • 3LIW · Factor XA in complex with (R)-2-(1-ADAMANTYLCARBAMOYLAMINO)-3-(3-CARBAMIDOYL-PHENYL)-N-PHE… · RUP A1 · binds LYS96, GLU97, THR98, TYR99, ARG143, GLU146, PHE174, ASP189 and 13 more
  • 3LIW · Factor xa in complex with (R)-2-(1-adamantylcarbamoylamino)… · RUP A1 · binds LYS96, GLU97, THR98, TYR99, ARG143, GLU146, PHE174, ASP189 and 13 more

Residues it binds most

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

Found with

  • CA · Calcium ion

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