GL1X · GenesisL1 explorer

Ligand · TJW

TJW · 5-amino-N-(4-(((2S)-4-cyclohexyl-1-((1-(methylsulfonyl)piperidin-3-yl)amino)-1-oxobutan-2-yl)carbamoyl)benzyl)-1-phenyl-1H-pyrazole-4-carboxamide

TJW, 5-amino-N-(4-(((2S)-4-cyclohexyl-1-((1-(methylsulfonyl)piperidin-3-yl)amino)-1-oxobutan-2-yl)carbamoyl)benzyl)-1-phenyl-1H-pyrazole-4-carboxamide (C34 H45 N7 O5 S, 663.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record…

Component
TJW
Formula
C34 H45 N7 O5 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

TJW in 1 structure; the first of them:

  • 7BE6 · Structure of DDR1 receptor tyrosine kinase in complex with inhibitor SR159 · TJW A1009 · binds VAL624, ALA653, GLU672, ILE675, MET676, ILE685, MET699, THR701 and 12 more

Residues it binds most

ILE 1, MET 1, ALA 1, ASP 1, GLU 1, GLY 1, PHE 1, HIS 1, THR 1, TYR 1 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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