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Ligand · D0P

D0P · N-(2',4'-difluoro-4-hydroxy[1,1'-biphenyl]-3-yl)-2-sulfanylacetamide

D0P, N-(2',4'-difluoro-4-hydroxy[1,1'-biphenyl]-3-yl)-2-sulfanylacetamide (C14 H11 F2 N O2 S, 295.3 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…

Component
D0P
Formula
C14 H11 F2 N O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

D0P in 2 structures; the first of them:

  • 6B95 · Multiconformer model of K197C PTP1B tethered to compound 2 at 100 K · D0P A402 · binds ARG105, ASP148, LYS150, VAL155, GLN157, GLU170, LEU172, CYS197 and 2 more
  • 6B95 · Multiconformer model of K197C PTP1B tethered to compound 2 at 100 K · D0P A402 · binds ARG105, ASP148, LYS150, VAL155, GLN157, GLU170, LEU172, CYS197 and 2 more

Residues it binds most

GLU 2, ARG 2, ASP 2, CYS 2, GLN 2, LEU 2, LYS 2, SER 2, VAL 2 (residue and the binding sites it lines).

Found with

  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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