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Ligand · CHQ

CHQ · Cyclo-(L-histidine-L-proline) inhibitor

CHQ, Cyclo-(L-histidine-L-proline) inhibitor (C11 H14 N4 O2, 234.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
CHQ
Formula
C11 H14 N4 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

CHQ in 4 structures; the first of them:

  • 1W1T · Crystal structure of S. marcescens chitinase B in complex with the cyclic dipeptide… · CHQ A1513 · binds TYR10, PHE51, GLY96, TRP97, ASP142, GLU144, TYR145, ALA184 and 5 more
  • 3N1A · Crystal stricture of E145G/Y227F chitinase in complex with cyclo-(L-His-L-Pro) from… · CHQ A1514 · binds PHE43, PHE66, GLY108, GLN109, ASP143, GLN225, PHE227, ASN228 and 2 more
  • 1W1T · Crystal structure of S. marcescens chitinase B in complex with the cyclic dipeptide… · CHQ A1513 · binds TYR10, PHE51, GLY96, TRP97, ASP142, GLU144, TYR145, ALA184 and 5 more
  • 3N1A · Crystal stricture of E145G/Y227F chitinase in complex with cyclo-(L- his-L-pro) from… · CHQ A1514 · binds PHE43, PHE66, GLY108, GLN109, ASP143, GLN225, PHE227, ASN228 and 2 more

Residues it binds most

TRP 10, TYR 6, ASP 10, PHE 10, ALA 6, GLY 6, ARG 4, GLN 2, GLU 4, MET 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol

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