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Ligand · SRL

SRL · [2-(3,5-di-tert-butyl-4-hydroxy-phenyl)-1-(diethoxy-phosphoryl)-vinyl]-phosphonic acid diethlyl ester

SRL, [2-(3,5-di-tert-butyl-4-hydroxy-phenyl)-1-(diethoxy-phosphoryl)-vinyl]-phosphonic acid diethlyl ester (C24 H42 O7 P2, 504.5 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries). Every binding site with its…

Component
SRL
Formula
C24 H42 O7 P2
Class
ligand
Structures
8
PDB entries
4

Binding sites

SRL in 8 structures; the first of them:

  • 1ILH · Crystal Structure of Human Pregnane X Receptor Ligand Binding Domain Bound to SR12813 · SRL A1 · binds SER208, VAL211, MET243, MET246, SER247, PHE251, PHE281, CYS284 and 9 more
  • 1NRL · Crystal Structure of the human PXR-LBD in complex with an SRC-1 coactivator peptide and… · SRL A1 · binds LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251, PHE281 and 13 more
  • 3HVL · Tethered PXR-LBD/SRC-1p complexed with SR-12813 · SRL A1 · binds LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251, PHE281 and 15 more
  • 4J5X · Crystal Structure of the SR12813-bound PXR/RXRalpha LBD Heterotetramer Complex · SRL A501 · binds LEU206, LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251 and 12 more
  • 1ILH · Crystal structure of human pregnane X receptor ligand binding domain bound to SR12813 · SRL A1 · binds SER208, VAL211, MET243, MET246, SER247, PHE251, PHE281, CYS284 and 9 more
  • 1NRL · Crystal structure of the human pxr-lbd in complex with an src-1 coactivator peptide and… · SRL A1 · binds LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251, PHE281 and 13 more
  • 3HVL · Tethered pxr-LBD/SRC-1P complexed with sr-12813 · SRL A1 · binds LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251, PHE281 and 15 more
  • 4J5X · Crystal structure of the SR12813-bound PXR/RXRALPHA lbd heterotetramer complex · SRL A501 · binds LEU206, LEU209, LEU240, MET243, ALA244, MET246, SER247, PHE251 and 12 more

Residues it binds most

PHE 14, LEU 14, MET 14, HIS 14, SER 14, GLN 14, TRP 14, TYR 14, ALA 10, ARG 10 (residue and the binding sites it lines).

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