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Ligand · SQC

SQC · 3-[4-(morpholin-4-yl)phenyl]-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione

SQC, 3-[4-(morpholin-4-yl)phenyl]-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione (C20 H19 N3 O3, 349.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries). Every binding site with its residues within…

Component
SQC
Formula
C20 H19 N3 O3
Class
ligand
Structures
3
PDB entries
3

Binding sites

SQC in 3 structures; the first of them:

  • 8G07 · Cryo-EM structure of SQ31f-bound Mycobacterium smegmatis ATP synthase FO region · SQC 9601 · binds GLY62, LEU63, ALA66, ALA67, ILE70, PHE58, VAL61, GLY62 and 15 more
  • 8G09 · Cryo-EM structure of SQ31f-bound Mycobacterium smegmatis ATP synthase rotational state 2… · SQC 4601 · binds GLY62, LEU63, ALA67, ILE173, PHE58, GLY62
  • 8G0A · Cryo-EM structure of SQ31f-bound Mycobacterium smegmatis ATP synthase rotational state 3 · SQC 1601 · binds GLY62, LEU63, ALA66, ALA67, ILE70, HIS166, ILE173, ASN174 and 15 more

Residues it binds most

ALA 3, LEU 3, GLY 3, ILE 3, PHE 3, GLU 2, TYR 2, ARG 2, ASN 2, GLN 2 (residue and the binding sites it lines).

Found with

  • ATP · Adenosine-5'-triphosphate
  • MG · Magnesium ion
  • PO4 · Phosphate ion

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