Ligand · S92

S92 · 7-(cyclopropylamino)-5-(5-(6-oxo-1,6-dihydropyridin-3-yl)-1-(2-(piperidin-1-yl)ethyl)-1H-1,2,3-triazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

S92, 7-(cyclopropylamino)-5-(5-(6-oxo-1,6-dihydropyridin-3-yl)-1-(2-(piperidin-1-yl)ethyl)-1H-1,2,3-triazol-4-yl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile (C24 H26 N10 O, 470.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component: S92
Formula: C24 H26 N10 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

S92 in 2 structures; the first of them:

7AY9 · Crystal structure of CK2 bound by compound 7 · S92 A407 · binds LEU45, GLY46, ARG47, VAL53, VAL66, LYS68, ILE95, PHE113 and 9 more
7AY9 · Crystal structure of CK2 bound by compound 7 · S92 A407 · binds LEU45, GLY46, ARG47, VAL53, VAL66, LYS68, ILE95, PHE113 and 9 more

Residues it binds most

VAL 4, ASN 4, HIS 4, ILE 4, ARG 4, ASP 4, GLU 4, GLY 4, LEU 4, LYS 4 (residue and the binding sites it lines).

Found with

SO4 · Sulfate ion
EDO · 1,2-ethanediol

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