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Ligand · N2J

N2J · N-[(1S,3aR,6aR)-5-hexyl-4-phenyl-3a-(1-phenylethenyl)-1,2,3,3a,6,6a-hexahydropentalen-1-yl]sulfuric diamide

N2J, N-[(1S,3aR,6aR)-5-hexyl-4-phenyl-3a-(1-phenylethenyl)-1,2,3,3a,6,6a-hexahydropentalen-1-yl]sulfuric diamide (C28 H36 N2 O2 S, 464.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
N2J
Formula
C28 H36 N2 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

N2J in 2 structures; the first of them:

  • 6OQY · Human LRH-1 bound to the agonist 6N and a fragment of the Tif2 coregulator · N2J A601 · binds PHE342, MET345, CYS346, MET348, ALA349, THR352, LEU386, ILE387 and 13 more
  • 6OQY · Human lrh-1 bound to the agonist 6N and a fragment of the TIF2 coregulator · N2J A601 · binds PHE342, MET345, CYS346, MET348, ALA349, THR352, ILE387, HIS390 and 9 more

Residues it binds most

LEU 2, ALA 2, ILE 2, MET 2, CYS 2, HIS 2, PHE 2, THR 2, VAL 2, ARG 1 (residue and the binding sites it lines).

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