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Ligand · 4DL

4DL · 2-[{2-[(1,1-dioxido-2,3-dihydro-1,2-benzothiazol-6-yl)amino]pyrimidin-4-yl}(1H-indazol-4-yl)amino]ethanol

4DL, 2-[{2-[(1,1-dioxido-2,3-dihydro-1,2-benzothiazol-6-yl)amino]pyrimidin-4-yl}(1H-indazol-4-yl)amino]ethanol (C20 H19 N7 O3 S, 437.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
4DL
Formula
C20 H19 N7 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

4DL in 2 structures; the first of them:

  • 4YJP · The kinase domain of human spleen tyrosine (syk) in complex with GTC000223 · 4DL A701 · binds LEU377, GLY378, VAL385, ALA400, VAL401, LYS402, GLU420, MET424 and 12 more
  • 4YJP · The kinase domain of human spleen tyrosine (syk) in complex with GTC000223 · 4DL A701 · binds LEU377, GLY378, VAL385, ALA400, VAL401, LYS402, GLU420, MET424 and 12 more

Residues it binds most

GLU 2, LEU 2, MET 2, VAL 2, ALA 2, GLY 2, ASP 2, LYS 2, PRO 2, SER 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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