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Ligand · P77

P77 · 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine

P77, 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine (C20 H24 Cl N3 S, 373.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
P77
Formula
C20 H24 Cl N3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

P77 in 2 structures; the first of them:

  • 3M0W · Structure of S100A4 with PCP · P77 A203 · binds ASP10, SER14, PHE89, PHE90, GLU6, LEU9, ASP10, SER44 and 5 more
  • 3M0W · Structure of S100A4 with pcp · P77 A203 · binds ASP10, SER14, PHE89, PHE90, GLU6, LEU9, ASP10, SER44 and 5 more

Residues it binds most

PHE 24, SER 22, ASP 20, CYS 24, GLU 22, ILE 24, LEU 22, MET 4, GLY 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • DIO · 1,4-diethylene dioxide

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