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Ligand · 4M1

4M1 · 2,6-dichloro-N-[(2R)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-phenylethyl]-4-(4H-1,2,4-triazol-4-yl)benzamide

4M1, 2,6-dichloro-N-[(2R)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-phenylethyl]-4-(4H-1,2,4-triazol-4-yl)benzamide (C26 H22 Cl2 N6 O, 505.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
4M1
Formula
C26 H22 Cl2 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

4M1 in 2 structures; the first of them:

  • 4ZAE · Development of a novel class of potent and selective FIXa inhibitors · 4M1 A301 · binds ASN97, TYR99, ARG143, HIS147, LYS148, PHE174, ASP189, SER190 and 10 more
  • 4ZAE · Development of a novel class of potent and selective fixa inhibitors · 4M1 A301 · binds ASN97, TYR99, ARG143, HIS147, LYS148, PHE174, ASP189, SER190 and 10 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • NHE · 2-[N-cyclohexylamino]ethane sulfonic acid

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