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Ligand · 339

339 · (S)-2-(3-((R)-1-(4-bromophenyl)ethyl)ureido)-N-((S)-1-((S)-5-guanidino-1-oxo-1-(thiazol-2-yl)pentan-2-ylamino)-3-methyl-1-oxobutan-2-yl)-5-ureidopentanamide

339, (S)-2-(3-((R)-1-(4-bromophenyl)ethyl)ureido)-N-((S)-1-((S)-5-guanidino-1-oxo-1-(thiazol-2-yl)pentan-2-ylamino)-3-methyl-1-oxobutan-2-yl)-5-ureidopentanamide (C29 H45 Br N10 O5 S, 725.7 g/mol), in the MolNFT structures on GenesisL1…

Component
339
Formula
C29 H45 Br N10 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

339 in 2 structures; the first of them:

  • 1ZOM · Crystal Structure of the Catalytic Domain of Coagulation Factor XI in complex with a… · 339 A1001 · binds HIS57, ALA97, GLU98, HIS174, ASP189, ALA190, CYS191, LYS192 and 13 more
  • 1ZOM · Crystal structure of the catalytic domain of coagulation factor XI in complex with a… · 339 A1001 · binds HIS57, ALA97, GLU98, HIS174, ASP189, ALA190, CYS191, LYS192 and 13 more

Residues it binds most

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

Found with

  • SO4 · Sulfate ion

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