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Ligand · I1T

I1T · (1S,3R,4S)-3-formyl-4-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl) amino]cyclopentane-1-carboxylic acid

I1T, (1S,3R,4S)-3-formyl-4-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl) amino]cyclopentane-1-carboxylic acid (C15 H21 N2 O8 P, 388.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries).…

Component
I1T
Formula
C15 H21 N2 O8 P
Class
ligand
Structures
2
PDB entries
2

Binding sites

I1T in 2 structures; the first of them:

  • 7TED · Human ornithine aminotransferase cocrystallized with its inhibitor… · I1T A501 · binds TYR55, TYR85, THR141, GLY142, VAL143, PHE177, TRP178, GLY179 and 11 more
  • 7TEV · Human ornithine aminotransferase cocrystallized with its inhibitor… · I1T A501 · binds TYR55, TYR85, THR141, GLY142, VAL143, PHE177, TRP178, GLY179 and 6 more

Residues it binds most

GLY 11, GLU 11, TYR 11, ARG 10, THR 11, ASP 11, GLN 11, ILE 11, PHE 11, TRP 11 (residue and the binding sites it lines).

Found with

  • PLP · Pyridoxal-5'-phosphate

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