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Ligand · 92X

92X · 1,5-dimethyl-3-(2-methylphenyl)-6-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)carbonyl-quinazoline-2, 4-dione

92X, 1,5-dimethyl-3-(2-methylphenyl)-6-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)carbonyl-quinazoline-2, 4-dione (C24 H22 N2 O5, 418.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (4 PDB entries). Every binding site…

Component
92X
Formula
C24 H22 N2 O5
Class
ligand
Structures
4
PDB entries
4

Binding sites

92X in 4 structures; the first of them:

  • 7XVH · Crystal structure of AtHPPD-Y13287 complex · 92X A502 · binds HIS226, VAL228, SER263, LEU265, SER267, PRO280, ASN282, GLN293 and 13 more
  • 8XC3 · Crystal structure of ZmHSL1A-MBQ complex · 92X B403 · binds ARG117, PHE118, MET120, GLN142, ARG144, SER205, ILE207, ARG209 and 8 more
  • 5YWK · Crystal structure of arabidopsis thaliana hppd complexed with benquitrione-methyl · 92X A502 · binds HIS226, VAL228, SER267, PRO280, ASN282, HIS308, MET335, LEU368 and 9 more
  • 7X8E · Crystal structure of pfhppd-Y13287 complex · 92X A402 · binds HIS161, THR163, SER201, PRO214, ASN216, GLN225, GLN239, HIS240 and 10 more

Residues it binds most

PHE 12, HIS 11, ASN 11, GLN 12, SER 12, LEU 11, GLU 11, GLY 11, PRO 11, MET 9 (residue and the binding sites it lines).

Found with

  • CO · Cobalt (II) ion
  • AKG · 2-oxoglutaric acid

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