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Ligand · NTD

NTD · 2-{hydroxy[2-nitro-4-(trifluoromethyl) phenyl]methylene}cyclohexane-1,3-dione

NTD, 2-{hydroxy[2-nitro-4-(trifluoromethyl) phenyl]methylene}cyclohexane-1,3-dione (C14 H10 F3 N O5, 329.2 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5…

Component
NTD
Formula
C14 H10 F3 N O5
Class
ligand
Structures
3
PDB entries
2

Binding sites

NTD in 3 structures; the first of them:

  • 6J63 · Crystal structure of Arabidopsis thaliana HPPD complexed with NTBC · NTD A502 · binds HIS226, VAL228, SER267, PRO280, ASN282, GLN307, HIS308, LEU368 and 8 more
  • 5YWI · Crystal structure of arabidopsis thaliana hppd truncated mutant complexed with ntbc · NTD A502 · binds HIS226, VAL228, SER267, PRO280, GLN307, HIS308, LEU368, GLN379 and 8 more
  • 6J63 · Crystal structure of arabidopsis thaliana hppd complexed with ntbc · NTD A502 · binds HIS226, VAL228, PRO280, ASN282, HIS308, LEU368, GLN379, PHE381 and 6 more

Residues it binds most

PHE 9, LEU 9, HIS 9, ASN 9, GLN 9, GLU 9, GLY 9, PRO 8, SER 7, VAL 7 (residue and the binding sites it lines).

Found with

  • FE · Fe (III) ion
  • CO · Cobalt (II) ion

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