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Ligand · GZR

GZR · 1-[(1S)-1-(4-fluorophenyl)ethyl]-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]piperidin-2-one

GZR, 1-[(1S)-1-(4-fluorophenyl)ethyl]-3-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methylidene]piperidin-2-one (C25 H26 F N3 O2, 419.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
GZR
Formula
C25 H26 F N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

GZR in 2 structures; the first of them:

  • 7D8X · CryoEM structure of human gamma-secretase in complex with E2012 and L685458 · GZR B502 · binds ILE242, ASN243, PHE105, TYR106, PHE176, PHE177, ILE180, TYR181 and 3 more
  • 7D8X · Cryoem structure of human gamma-secretase in complex with E2012 and L685458 · GZR B502 · binds ILE242, ASN243, PHE105, TYR106, PHE177, ILE180, VAL236, TYR240

Residues it binds most

PHE 2, TYR 2, ILE 2, ASN 2, VAL 2, LEU 1 (residue and the binding sites it lines).

Found with

  • CLR · Cholesterol
  • FTO · ~{tert}-butyl ~{N}-[(2~{S},3~{R},5~{R})-6-[[(2~{S})-1-[[(2~{S})-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl) hexan-2-yl]carbamate
  • PC1 · 1,2-diacyl-sn-glycero-3-phosphocholine
  • PTY · Phosphatidylethanolamine
  • BMA · beta-D-mannopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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