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Ligand · G9V

G9V · 6-(but-3-en-1-yl)-4-[1-methyl-6-(morpholine-4-carbonyl)-1H-benzimidazol-4-yl]-1,6-dihydro-7H-pyrrolo[2,3-c]pyridin-7-one

G9V, 6-(but-3-en-1-yl)-4-[1-methyl-6-(morpholine-4-carbonyl)-1H-benzimidazol-4-yl]-1,6-dihydro-7H-pyrrolo[2,3-c]pyridin-7-one (C24 H25 N5 O3, 431.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…

Component
G9V
Formula
C24 H25 N5 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

G9V in 4 structures; the first of them:

  • 6DF7 · TAF1-BD2 in complex with Cpd27 (6-(but-3-en-1-yl)-4-(1-methyl-6-(morpholine-4-carbonyl)-1H… · G9V A4001 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 7 more
  • 7L6X · Crystal structure of the tandem bromodomain (BD1, BD2) of human TAF1 bound to GNE-371 · G9V A1701 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 7 more
  • 6DF7 · TAF1-BD2 in complex with CPD27 (6-(but-3-en-1-yl)-4-(1-methyl-6… · G9V A4001 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 7 more
  • 7L6X · Crystal structure of the tandem bromodomain (BD1, BD2) of human TAF1 bound to gne-371 · G9V A1701 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 7 more

Residues it binds most

TYR 6, ASN 6, PHE 6, PRO 6, VAL 6, ASP 6, HIS 6, MET 6, TRP 6 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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