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Ligand · Q62

Q62 · ~{N}-[(5~{S})-5-[[2,3-bis(oxidanyl)phenyl]carbonylamino]-6-oxidanylidene-6-(prop-2-ynylamino)hexyl]-2,3-bis(oxidanyl)benzamide

Q62, ~{N}-[(5~{S})-5-[[2,3-bis(oxidanyl)phenyl]carbonylamino]-6-oxidanylidene-6-(prop-2-ynylamino)hexyl]-2,3-bis(oxidanyl)benzamide (C23 H25 N3 O7, 455.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component
Q62
Formula
C23 H25 N3 O7
Class
ligand
Structures
1
PDB entries
1

Binding sites

Q62 in 1 structure; the first of them:

  • 6Z33 · Crystal structure of the ferric enterobactin receptor (PfeA) in complex with BCV · Q62 AAA801 · binds LYS218, GLN219, ASN268, ALA323, GLY324, GLY325, THR326, TYR478 and 5 more

Residues it binds most

GLY 1, GLN 1, ALA 1, ARG 1, ASN 1, LYS 1, SER 1, THR 1, TYR 1, VAL 1 (residue and the binding sites it lines).

Found with

  • FE · Fe (III) ion
  • EDO · 1,2-ethanediol

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