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Ligand · B65

B65 · (1R)-4-(3-phenoxyphenyl)-1-phosphonobutane-1-sulfonic acid

B65, (1R)-4-(3-phenoxyphenyl)-1-phosphonobutane-1-sulfonic acid (C16 H19 O7 P S, 386.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
B65
Formula
C16 H19 O7 P S
Class
ligand
Structures
4
PDB entries
2

Binding sites

B65 in 4 structures; the first of them:

  • 2ZCQ · Crystal structure of the C(30) carotenoid dehydrosqualene synthase from Staphylococcus… · B65 A451 · binds MET15, PHE22, PHE26, TYR41, CYS44, ARG45, ASP48, ASP52 and 8 more
  • 3LEE · Crystal structure of the human squalene synthase complexed with BPH-652 · B65 A451 · binds PHE54, ILE58, VAL69, PHE72, TYR73, LEU76, ARG77, ASP80 and 9 more
  • 2ZCQ · Crystal structure of the C(30) carotenoid dehydrosqualene synthase from staphylococcus… · B65 A451 · binds MET15, PHE22, PHE26, TYR41, CYS44, ARG45, ASP48, ASP52 and 8 more
  • 3LEE · Crystal structure of the human squalene synthase complexed with bph- 652 · B65 A451 · binds PHE54, ILE58, VAL69, PHE72, TYR73, LEU76, ARG77, ASP80 and 9 more

Residues it binds most

PHE 14, VAL 14, ASP 14, LEU 14, TYR 14, ARG 14, GLN 12, ILE 10, MET 10, GLU 8 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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