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Ligand · 3RQ

3RQ · 4-(2,4-dichloro-5-methoxyphenyl)-2-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

3RQ, 4-(2,4-dichloro-5-methoxyphenyl)-2-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile (C15 H10 Cl2 N4 O, 333.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
3RQ
Formula
C15 H10 Cl2 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

3RQ in 2 structures; the first of them:

  • 3RLQ · Co-crystal structure of the HSP90 ATP binding domain in complex with… · 3RQ A901 · binds LEU48, ASN51, SER52, ALA55, ASP93, ILE96, GLY97, MET98 and 8 more
  • 3RLQ · Co-crystal structure of the HSP90 ATP binding domain in complex with… · 3RQ A901 · binds LEU48, ASN51, SER52, ALA55, ASP93, ILE96, GLY97, MET98 and 8 more

Residues it binds most

ASN 4, GLY 4, LEU 4, VAL 4, ALA 4, ASP 4, ILE 4, MET 4, PHE 4, SER 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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