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Ligand · G1T

G1T · 8-(oxidanylamino)-2-piperidin-1-yl-6-(trifluoromethyl)-1,3-benzothiazin-4-one

G1T, 8-(oxidanylamino)-2-piperidin-1-yl-6-(trifluoromethyl)-1,3-benzothiazin-4-one (C14 H14 F3 N3 O2 S, 345.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within…

Component
G1T
Formula
C14 H14 F3 N3 O2 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

G1T in 4 structures; the first of them:

  • 6HFV · Mycobacterium tuberculosis DprE1 in complex with CMP2 · G1T A503 · binds GLY117, HIS132, GLY133, LYS134, SER228, TRP230, TYR314, LEU317 and 7 more
  • 6HFW · Mycobacterium tuberculosis DprE1 in complex with CMP1 · G1T A503 · binds GLY117, HIS132, GLY133, LYS134, SER227, SER228, TRP230, TYR314 and 8 more
  • 6HFV · Mycobacterium tuberculosis DPRE1 in complex with CMP2 · G1T A503 · binds GLY117, HIS132, GLY133, LYS134, SER228, LEU317, GLN336, VAL365 and 5 more
  • 6HFW · Mycobacterium tuberculosis DPRE1 in complex with CMP1 · G1T A503 · binds GLY117, HIS132, GLY133, LYS134, SER228, TRP230, LEU317, GLN336 and 5 more

Residues it binds most

LYS 8, GLY 8, SER 8, ASN 8, CYS 8, GLN 8, HIS 8, LEU 8, VAL 8, PHE 7 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • IMD · Imidazole

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