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Ligand · XXV

XXV · 1-{6-[(3R)-3-methylmorpholin-4-yl]-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrimidin-4-yl}cyclopropane-1-sulfonamide

XXV, 1-{6-[(3R)-3-methylmorpholin-4-yl]-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrimidin-4-yl}cyclopropane-1-sulfonamide (C19 H22 N6 O3 S, 414.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
XXV
Formula
C19 H22 N6 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

XXV in 2 structures; the first of them:

  • 7LB0 · Crystal structure of the tandem bromodomain (BD1, BD2) of human TAF1 bound to ZS1-295 · XXV A1701 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 5 more
  • 7LB0 · Crystal structure of the tandem bromodomain (BD1, BD2) of human TAF1 bound to ZS1-295 · XXV A1701 · binds TRP1526, PRO1527, PHE1528, HIS1530, PRO1531, VAL1532, ASN1533, PHE1536 and 4 more

Residues it binds most

TYR 2, ASN 2, PHE 2, PRO 2, VAL 2, HIS 2, TRP 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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