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Ligand · FA1

FA1 · 2,3 -anhydro-quinic acid

FA1, 2,3 -anhydro-quinic acid (C7 H10 O5, 174.2 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
FA1
Formula
C7 H10 O5
Class
ligand
Structures
8
PDB entries
4

Binding sites

FA1 in 8 structures; the first of them:

  • 1GU1 · Crystal structure of type II dehydroquinase from Streptomyces coelicolor complexed with… · FA1 A201 · binds TYR28, ASN79, ALA81, ALA82, HIS85, HIS106, ILE107, SER108 and 4 more
  • 1H0R · Type II Dehydroquinase from Mycobacterium tuberculosis complexed with 2,3-anhydro-quinic… · FA1 A200 · binds TYR24, ASN75, GLY77, GLY78, HIS81, HIS101, ILE102, SER103 and 3 more
  • 2C57 · H.pylori type II dehydroquinase in complex with FA1 · FA1 A1159 · binds ASN76, GLY78, ALA79, SER81, HIS82, HIS102, LEU103, THR104 and 4 more
  • 3N7A · Crystal structure of 3-dehydroquinate dehydratase from Mycobacterium tuberculosis in… · FA1 A147 · binds LEU13, TYR24, ASN75, GLY77, GLY78, HIS81, HIS101, ILE102 and 6 more

Residues it binds most

ARG 98, HIS 98, VAL 74, GLY 74, ILE 98, ASN 98, ASP 96, SER 78, ALA 48, TYR 72 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol
  • CL · Chloride ion
  • PO4 · Phosphate ion
  • TLA · L(+)-tartaric acid
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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