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Ligand · 1JA

1JA · 2-ethylpyridine-4-carboximidothioic acid

1JA, 2-ethylpyridine-4-carboximidothioic acid (C8 H10 N2 S, 166.2 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 residues it binds most and the…

Component
1JA
Formula
C8 H10 N2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

1JA in 2 structures; the first of them:

  • 7F72 · Rv3094c in complex with FAD and ETH. · 1JA A401 · binds TRP115, PRO117, PRO158, SER159, VAL160, VAL202, PHE203, PHE218 and 4 more
  • 7F72 · RV3094C in complex with FAD and eth. · 1JA A401 · binds TRP115, PRO117, PRO158, VAL202, PHE203, PHE218, PHE352, GLN353 and 1 more

Residues it binds most

PHE 2, PRO 2, VAL 2, GLN 2, MET 2, TRP 2, SER 1 (residue and the binding sites it lines).

Found with

  • FMN · Flavin mononucleotide

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