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Ligand · BV3

BV3 · 1,3-bis-([[3-(4-{3-[3-nitro-5-(galactopyranosyloxy)-benzoylamino]-propyl}-piperazin-1-yl)-propylamino-3,4-dioxo-cyclobu tenyl]-amino-ethyl]-amino-carbonyloxy)-2-amino-propane

BV3, 1,3-bis-([[3-(4-{3-[3-nitro-5-(galactopyranosyloxy)-benzoylamino]-propyl}-piperazin-1-yl)-propylamino-3,4-dioxo-cyclobu tenyl]-amino-ethyl]-amino-carbonyloxy)-2-amino-propane (C63 H91 N15 O26, 1474.5 g/mol), in the MolNFT structures…

Component
BV3
Formula
C63 H91 N15 O26
Class
ligand
Structures
2
PDB entries
1

Binding sites

BV3 in 2 structures; the first of them:

  • 1RDP · Cholera Toxin B-Pentamer Complexed With Bivalent Nitrophenol-Galactoside Ligand BV3 · BV3 D104 · binds TYR12, GLU51, GLN56, HIS57, GLN61, TRP88, ASN90, LYS91 and 2 more
  • 1RDP · Cholera toxin B-pentamer complexed with bivalent nitrophenol-galactoside ligand BV3 · BV3 D104 · binds TYR12, GLU51, GLN56, HIS57, GLN61, TRP88, ASN90, LYS91 and 2 more

Residues it binds most

GLN 10, ALA 10, ASN 10, GLU 10, GLY 10, HIS 10, LYS 10, TRP 10, TYR 10 (residue and the binding sites it lines).

Found with

  • PGE · Triethylene glycol
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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