Ligand · 624

624 · 2-(2-(3,4-dichlorophenyl)-5-(isopropylamino)-6-oxopyrimidin-1(6H)-yl)-N-((S)-1-oxo-1-(thiazol-2-yl)-5-guanidinopentan-2-yl)acetamide

624, 2-(2-(3,4-dichlorophenyl)-5-(isopropylamino)-6-oxopyrimidin-1(6H)-yl)-N-((S)-1-oxo-1-(thiazol-2-yl)-5-guanidinopentan-2-yl)acetamide (C24 H28 Cl2 N8 O3 S, 579.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component: 624
Formula: C24 H28 Cl2 N8 O3 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

624 in 2 structures; the first of them:

1ZSL · Factor XI complexed with a pyrimidi inhibitor · 624 A900 · binds LEU39, HIS57, TYR59A, TYR94, ALA97, GLU98, HIS174, ASP189 and 16 more
1ZSL · Factor XI complexed with a pyrimidinone inhibitor · 624 A900 · binds LEU39, HIS57, TYR59A, TYR94, ALA97, GLU98, HIS174, ASP189 and 16 more

Residues it binds most

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

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