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Ligand · H1F

H1F · 5-phenyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide

H1F, 5-phenyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide (C19 H21 N3 O3 S, 371.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
H1F
Formula
C19 H21 N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

H1F in 2 structures; the first of them:

  • 7DBB · SSE in complex with tubulin · H1F B507 · binds THR179, ALA180, VAL181, VAL238, CYS241, LEU242, LEU248, ALA250 and 17 more
  • 7DBB · Sse in complex with tubulin · H1F B507 · binds THR179, VAL181, VAL238, CYS241, LEU242, LEU248, ALA250, LYS254 and 12 more

Residues it binds most

ALA 2, VAL 2, ASN 2, LEU 2, THR 2, LYS 2, ILE 2, CYS 2, MET 2, ASP 1 (residue and the binding sites it lines).

Found with

  • ACP · Phosphomethylphosphonic acid adenylate ester
  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • CA · Calcium ion
  • MG · Magnesium ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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