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Ligand · 6A4

6A4 · (4S)-2-sulfanylidene-4-[(tetradecanoyloxy)methyl]-1,3,2lambda~5~-dioxaphospholane-2-thiolate

6A4, (4S)-2-sulfanylidene-4-[(tetradecanoyloxy)methyl]-1,3,2lambda~5~-dioxaphospholane-2-thiolate (C17 H32 O4 P S2 -1, 395.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…

Component
6A4
Formula
C17 H32 O4 P S2 -1
Class
ligand
Structures
4
PDB entries
2

Binding sites

6A4 in 4 structures; the first of them:

  • 5ID7 · Crystal structure of human serum albumin in complex with phosphorodithioate derivative of… · 6A4 A601 · binds SER342, VAL344, LEU345, ARG348, PRO384, LEU387, ILE388, ASN391 and 13 more
  • 5ID9 · Crystal structure of equine serum albumin in complex with phosphorodithioate derivative… · 6A4 A601 · binds PHE205, ARG208, ALA209, LYS211, ALA212, VAL215, SER231, THR235 and 10 more
  • 5ID7 · Crystal structure of human serum albumin in complex with phosphorodithioate derivative of… · 6A4 A601 · binds SER342, VAL344, LEU345, ARG348, PRO384, LEU387, ILE388, ASN391 and 13 more
  • 5ID9 · Crystal structure of equine serum albumin in complex with phosphorodithioate derivative… · 6A4 A601 · binds PHE205, ARG208, ALA209, LYS211, ALA212, VAL215, SER231, THR235 and 10 more

Residues it binds most

LEU 14, PHE 14, VAL 14, ALA 14, ARG 10, SER 14, LYS 10, ASN 8, GLU 8, HIS 8 (residue and the binding sites it lines).

Found with

  • FMT · Formic acid
  • MLI · Malonate ion
  • PEG · Di(hydroxyethyl)ether
  • PGE · Triethylene glycol

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