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Ligand · AKV

AKV · {3-[(1R,3S)-1,3-dihydroxypentyl]-4,5,9,10-tetrahydroxy-2-anthryl}acetate

AKV, {3-[(1R,3S)-1,3-dihydroxypentyl]-4,5,9,10-tetrahydroxy-2-anthryl}acetate (C22 H22 O8, 414.4 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…

Component
AKV
Formula
C22 H22 O8
Class
ligand
Structures
2
PDB entries
1

Binding sites

AKV in 2 structures; the first of them:

  • 2F99 · Crystal structure of the polyketide cyclase AknH with bound substrate and product… · AKV A1335 · binds PHE39, ILE50, ASN51, TRP54, VAL55, PHE59, LEU83, MET91 and 9 more
  • 2F99 · Crystal structure of the polyketide cyclase aknh with bound substrate and product… · AKV A1335 · binds PHE39, ILE50, ASN51, TRP54, VAL55, PHE59, LEU83, MET91 and 9 more

Residues it binds most

TYR 8, PHE 8, TRP 8, VAL 8, MET 8, ASN 8, THR 8, ASP 8, GLN 8, ILE 8 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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