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Ligand · 737

737 · N-[4-guanidino-1-(thiazole-2-carbonyl)-butyl]-2-{6-oxo-5-[(quinolin-8-ylmethyl)-amino]-2-M-tolyl-6H-pyrimidin-1-yl}-acetamide

737, N-[4-guanidino-1-(thiazole-2-carbonyl)-butyl]-2-{6-oxo-5-[(quinolin-8-ylmethyl)-amino]-2-M-tolyl-6H-pyrimidin-1-yl}-acetamide (C32 H33 N9 O3 S, 623.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
737
Formula
C32 H33 N9 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

737 in 2 structures; the first of them:

  • 1ZTL · Crystal Structure of the Catalytic Domain of Coagulation Factor XI in Complex with… · 737 A248 · binds LEU39, HIS57, TYR59A, ALA97, GLU98, ASP189, ALA190, CYS191 and 13 more
  • 1ZTL · Crystal structure of the catalytic domain of coagulation factor XI in complex with… · 737 A248 · binds LEU39, HIS57, TYR59A, ALA97, GLU98, ASP189, ALA190, CYS191 and 13 more

Residues it binds most

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

Found with

  • SO4 · Sulfate ion

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