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Ligand · 6KA

6KA · N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-5-[(1S)-1-(3-methyl-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine

6KA, N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-5-[(1S)-1-(3-methyl-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine (C18 H17 Cl F N7 S, 417.9 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
6KA
Formula
C18 H17 Cl F N7 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

6KA in 1 structure; the first of them:

  • 5JFO · Structure of the M.tuberculosis enoyl-reductase InhA in complex with GSK625 · 6KA A302 · binds GLY96, PHE97, MET98, PRO99, GLN100, MET103, GLY104, PHE149 and 9 more

Residues it binds most

MET 4, ALA 4, GLY 4, ILE 4, PHE 4, GLN 4, LYS 4, PRO 4, TYR 4, LEU 3 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide

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