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Ligand · 3WK

3WK · 4-[(4-aminophenyl)amino]pyrido[2,3-d]pyrimidin-5(6H)-one

3WK, 4-[(4-aminophenyl)amino]pyrido[2,3-d]pyrimidin-5(6H)-one (C13 H11 N5 O, 253.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
3WK
Formula
C13 H11 N5 O
Class
ligand
Structures
1
PDB entries
1

Binding sites

3WK in 1 structure; the first of them:

  • 4X2G · Selection of fragments for kinase inhibitor design: decoration is key · 3WK A601 · binds ILE211, GLY212, VAL219, ALA230, LEU260, SER280, ASP281, TYR282 and 5 more

Residues it binds most

ASP 1, GLY 1, LEU 1, SER 1, ALA 1, HIS 1, ILE 1, TYR 1, VAL 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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