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Ligand · ETJ

ETJ · (3S,4R)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile

ETJ, (3S,4R)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carbonitrile (C16 H18 N2 O3, 286.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
ETJ
Formula
C16 H18 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

ETJ in 2 structures; the first of them:

  • 7VLT · Structure of SUR2B in complex with Mg-ATP/ADP and levcromakalim · ETJ A2001 · binds ALA541, PRO544, ILE545, VAL548, LEU572, HIS576, VAL579, ILE1004 and 6 more
  • 7VLT · Structure of SUR2B in complex with mg-ATP/ADP and levcromakalim · ETJ A2001 · binds ALA541, PRO544, ILE545, VAL548, HIS576, VAL579, ILE1004, ILE1007 and 4 more

Residues it binds most

ILE 2, VAL 2, LEU 2, TYR 2, ALA 2, ASP 2, HIS 2, PRO 2, THR 2 (residue and the binding sites it lines).

Found with

  • ADP · Adenosine-5'-diphosphate
  • ATP · Adenosine-5'-triphosphate
  • Y01 · Cholesterol hemisuccinate
  • MG · Magnesium ion

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