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Ligand · 19X

19X · 6-({4-[(3R)-3-aminopyrrolidin-1-yl]-5-chloro-6-ethyl-7H-pyrrolo[2,3-d]pyrimidin-2-yl}sulfanyl)-1H-isoindol-1-one

19X, 6-({4-[(3R)-3-aminopyrrolidin-1-yl]-5-chloro-6-ethyl-7H-pyrrolo[2,3-d]pyrimidin-2-yl}sulfanyl)-1H-isoindol-1-one (C20 H19 Cl N6 O S, 426.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
19X
Formula
C20 H19 Cl N6 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

19X in 2 structures; the first of them:

  • 4HY1 · Pyrrolopyrimidine inhibitors of dna gyrase b and topoisomerase iv, part i: structure… · 19X A1401 · binds ILE38, ASN41, SER42, GLU45, VAL66, ASP68, ARG71, GLY72 and 7 more
  • 4HY1 · Pyrrolopyrimidine inhibitors of DNA gyrase B and topoisomerase IV, part I: structure… · 19X A1401 · binds ILE38, ASN41, SER42, GLU45, VAL66, ASP68, ARG71, GLY72 and 7 more

Residues it binds most

ILE 4, ARG 4, VAL 4, ASP 4, ASN 4, GLU 4, GLY 4, MET 4, PRO 4, SER 4 (residue and the binding sites it lines).

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