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Ligand · 62A

62A · 2-(5-amino-6-oxo-2-M-tolyl-6H-pyrimidin-1-yl)-N-[4-guanidino-1-(thiazole-2-carbonyl)-butyl]-acetamide

62A, 2-(5-amino-6-oxo-2-M-tolyl-6H-pyrimidin-1-yl)-N-[4-guanidino-1-(thiazole-2-carbonyl)-butyl]-acetamide (C22 H26 N8 O3 S, 482.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
62A
Formula
C22 H26 N8 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

62A in 2 structures; the first of them:

  • 1ZTK · Crystal Structure of the Catalytic Domain of Coagulation Factor XI in Complex with… · 62A A321 · binds LEU39, CYS40, HIS57, CYS58, TYR59A, TYR94, ALA97, GLU98 and 15 more
  • 1ZTK · Crystal structure of the catalytic domain of coagulation factor XI in complex with… · 62A A321 · binds LEU39, CYS40, HIS57, CYS58, TYR59A, TYR94, ALA97, GLU98 and 15 more

Residues it binds most

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

Found with

  • SO4 · Sulfate ion

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