Ligand · 582

582 · 5-ethyl-3-methyl-1,5-dihydro-4H-pyrazolo[4,3-c]quinolin-4-one

582, 5-ethyl-3-methyl-1,5-dihydro-4H-pyrazolo[4,3-c]quinolin-4-one (C13 H13 N3 O, 227.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component: 582
Formula: C13 H13 N3 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

582 in 2 structures; the first of them:

2QHN · Crystal Structure of Chek1 in Complex with Inhibitor 1a · 582 A500 · binds LEU15, GLY16, VAL23, ALA36, VAL68, LEU84, GLU85, TYR86 and 5 more
2QHN · Crystal structure of CHEK1 in complex with inhibitor 1A · 582 A500 · binds LEU15, GLY16, VAL23, ALA36, VAL68, LEU84, GLU85, TYR86 and 5 more

Residues it binds most

LEU 2, GLU 2, GLY 2, VAL 2, ALA 2, CYS 2, SER 2, TYR 2 (residue and the binding sites it lines).

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