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Ligand · QWH

QWH · ~{N}-(3-bromanyl-2,6-dimethyl-pyridin-4-yl)propanamide

QWH, ~{N}-(3-bromanyl-2,6-dimethyl-pyridin-4-yl)propanamide (C10 H13 Br N2 O, 257.1 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 residues it binds…

Component
QWH
Formula
C10 H13 Br N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

QWH in 2 structures; the first of them:

  • 7A1Y · KRASG12C GDP form in complex with Cpd2 · QWH A201 · binds CYS12, GLY13, PRO34, THR35, ALA59, GLY60, GLN61, TYR64
  • 7A1Y · KRASG12C GDP form in complex with CPD2 · QWH A201 · binds CYS12, GLY13, PRO34, THR35, ALA59, GLY60, GLN61, TYR64

Residues it binds most

GLY 2, ALA 2, CYS 2, GLN 2, PRO 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • GDP · Guanosine-5'-diphosphate
  • MG · Magnesium ion
  • SO4 · Sulfate ion

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