GL1X · GenesisL1 explorer

Ligand · 7I5

7I5 · (2E)-3-(4-{[(1S,2R,4S,5S,6S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]heptane-2-sulfonyl](2,2,2-trifluoroethyl)amino}phenyl)prop-2-enoic acid

7I5, (2E)-3-(4-{[(1S,2R,4S,5S,6S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]heptane-2-sulfonyl](2,2,2-trifluoroethyl)amino}phenyl)prop-2-enoic acid (C29 H24 F3 N O7 S, 587.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
7I5
Formula
C29 H24 F3 N O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

7I5 in 2 structures; the first of them:

  • 7RS2 · Crystal Structure of the ER-alpha Ligand-binding Domain (L372S, L536S) in complex with… · 7I5 A601 · binds MET343, LEU346, THR347, LEU349, ALA350, GLU353, TRP383, LEU384 and 12 more
  • 7RS2 · Crystal structure of the er-alpha ligand-binding domain (L372S, L536S) in complex with… · 7I5 A601 · binds MET343, LEU346, THR347, LEU349, ALA350, GLU353, TRP383, LEU384 and 12 more

Residues it binds most

LEU 8, MET 8, VAL 8, GLU 8, GLY 8, PHE 8, ALA 8, ARG 8, HIS 8, ILE 8 (residue and the binding sites it lines).

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