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Ligand · U49

U49 · (20S)-19,20,21,22-tetrahydro-19-oxo-5H-18,20-ethano-12,14-etheno-6,10-metheno-18H-benz[d]imidazo[4,3-k][1,6,9,12]oxatri aza-cyclooctadecosine-9-carbonitrile

U49, (20S)-19,20,21,22-tetrahydro-19-oxo-5H-18,20-ethano-12,14-etheno-6,10-metheno-18H-benz[d]imidazo[4,3-k][1,6,9,12]oxatri aza-cyclooctadecosine-9-carbonitrile (C26 H21 N5 O2, 435.5 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
U49
Formula
C26 H21 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

U49 in 2 structures; the first of them:

  • 1LD8 · Co-crystal structure of Human Farnesyltransferase with farnesyldiphosphate and inhibitor… · U49 B1003 · binds TYR166, LEU596, SER599, TRP602, TRP606, ARG702, ASP797, CYS799 and 3 more
  • 1LD8 · Co-crystal structure of human farnesyltransferase with farnesyldiphosphate and inhibitor… · U49 B1003 · binds TYR166, LEU596, SER599, TRP602, TRP606, ARG702, ASP797, CYS799 and 3 more

Residues it binds most

TYR 2, TRP 2, ARG 2, ASP 2, CYS 2, HIS 2, LEU 2, SER 2 (residue and the binding sites it lines).

Found with

  • FPP · Farnesyl diphosphate
  • ZN · Zinc ion
  • FRU · beta-D-fructofuranose
  • GLC · alpha-D-glucopyranose
  • ACY · Acetic acid

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