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Ligand · T2Q

T2Q · 1-[[3-(4-methylsulfonylpiperidin-1-yl)phenyl]methyl]-5-[3-[4-(trifluoromethyloxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one

T2Q, 1-[[3-(4-methylsulfonylpiperidin-1-yl)phenyl]methyl]-5-[3-[4-(trifluoromethyloxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one (C27 H25 F3 N4 O5 S, 574.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
T2Q
Formula
C27 H25 F3 N4 O5 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

T2Q in 1 structure; the first of them:

  • 7B93 · Cryo-EM structure of mitochondrial complex I from mus musculus inhibited by iacs-2858 at… · T2Q H403 · binds TRP56, ASP80, VAL85, ARG87, MET164, PHE168, MET17, ALA18 and 16 more

Residues it binds most

ARG 1, PHE 1, ALA 1, MET 1, LEU 1, ASP 1, GLN 1, GLU 1, PRO 1, THR 1 (residue and the binding sites it lines).

Found with

  • 3PE · 1,2-diacyl-sn-glycero-3-phosphoethanolamine
  • ATP · Adenosine-5'-triphosphate
  • CDL · Cardiolipin
  • EHZ · ~{S}-[2-[3-[[(2~{R})-3,3-dimethyl-2-oxidanyl-4-phosphonooxy-butanoyl]amino]propanoylamino]ethyl] (3~{S})-3-oxidanyltetradecanethioate
  • FES · Fe2/s2 (inorganic) cluster
  • FMN · Flavin mononucleotide
  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate
  • PC1 · 1,2-diacyl-sn-glycero-3-phosphocholine
  • SF4 · Iron/sulfur cluster
  • ZN · Zinc ion

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