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Ligand · ES5

ES5 · quinolin-6-amine

ES5, quinolin-6-amine (C9 H8 N2, 144.2 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
ES5
Formula
C9 H8 N2
Class
ligand
Structures
3
PDB entries
2

Binding sites

ES5 in 3 structures; the first of them:

  • 3KQP · Crystal Structure of hPNMT in Complex AdoHcy and 6-Aminoquinoline · ES5 A290 · binds TYR35, ASN39, TYR40, ARG44, VAL53, LYS57, PHE182, GLU219 and 5 more
  • 7H8N · Group deposition for crystallographic fragment screening of Chikungunya virus nsP3… · ES5 A210 · binds ARG8, MET9, ASP10, CYS143, ARG144
  • 3KQP · Crystal structure of hpnmt in complex adohcy and 6-aminoquinoline · ES5 A290 · binds TYR35, ASN39, TYR40, ARG44, VAL53, LYS57, PHE182, GLU219 and 5 more

Residues it binds most

TYR 6, VAL 6, ARG 7, ASP 7, MET 7, ASN 4, GLU 4, LYS 4, PHE 4, CYS 3 (residue and the binding sites it lines).

Found with

  • SAH · S-adenosyl-L-homocysteine
  • CL · Chloride ion
  • DMS · Dimethyl sulfoxide
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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