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Ligand · 2WT

2WT · 2-[3-({4-[(1,3-benzodioxol-5-ylmethyl)amino]-4-oxobutanoyl}amino)phenyl]-6-hydroxy-3-iodo-1-methyl-1H-indole-5-carboxylic acid

2WT, 2-[3-({4-[(1,3-benzodioxol-5-ylmethyl)amino]-4-oxobutanoyl}amino)phenyl]-6-hydroxy-3-iodo-1-methyl-1H-indole-5-carboxylic acid (C28 H24 I N3 O7, 641.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
2WT
Formula
C28 H24 I N3 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

2WT in 2 structures; the first of them:

  • 4PVG · Crystal structure of protein tyrosine phosphatase Shp2 catalytic domain complex with… · 2WT A601 · binds CYS459, SER460, ALA461, GLY462, ILE463, GLY464, ARG465, THR466 and 2 more
  • 4PVG · Crystal structure of protein tyrosine phosphatase SHP2 catalytic domain complex with… · 2WT A601 · binds CYS459, SER460, ALA461, GLY462, ILE463, GLY464, ARG465, THR466 and 2 more

Residues it binds most

GLN 2, GLY 2, ALA 2, ARG 2, CYS 2, ILE 2, SER 2, THR 2 (residue and the binding sites it lines).

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