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Ligand · NTI

NTI · 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate

NTI, 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl acetate (C12 H9 N3 O5 S, 307.3 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…

Component
NTI
Formula
C12 H9 N3 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

NTI in 2 structures; the first of them:

  • 3V35 · Aldose reductase complexed with a nitro compound · NTI A317 · binds TRP20, VAL47, TYR48, TRP79, HIS110, TRP111, PHE122, PRO218 and 1 more
  • 3V35 · Aldose reductase complexed with a nitro compound · NTI A317 · binds TRP20, VAL47, TYR48, TRP79, HIS110, TRP111, PHE122, PRO218 and 1 more

Residues it binds most

TRP 2, HIS 2, PHE 2, PRO 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • DMF · Dimethylformamide

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