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Ligand · 49C

49C · (1R)-5'-[(2-chlorophenyl)sulfanyl]-4'-hydroxy-2,3-dihydrospiro[indene-1,2'-pyran]-6'(3'H)-one

49C, (1R)-5'-[(2-chlorophenyl)sulfanyl]-4'-hydroxy-2,3-dihydrospiro[indene-1,2'-pyran]-6'(3'H)-one (C19 H15 Cl O3 S, 358.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
49C
Formula
C19 H15 Cl O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

49C in 2 structures; the first of them:

  • 4RLS · Lactate Dehydrogenase in complex with inhibitor compound 47 · 49C D802 · binds VAL30, ARG98, ASN137, LEU164, ASP165, ARG168, HIS192, GLY193 and 8 more
  • 4RLS · Lactate dehydrogenase in complex with inhibitor compound 47 · 49C D802 · binds VAL30, ARG98, ASN137, LEU164, ASP165, ARG168, HIS192, GLY193 and 8 more

Residues it binds most

VAL 2, ARG 2, ASP 2, TYR 2, ALA 2, ASN 2, GLY 2, HIS 2, ILE 2, LEU 2 (residue and the binding sites it lines).

Found with

  • 2OP · (2S)-2-hydroxypropanoic acid
  • NAI · 1,4-dihydronicotinamide adenine dinucleotide
  • SO4 · Sulfate ion

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