Ligand · S41
S41 · N,N-dimethyl-5-({2-methyl-6-[(5-methylpyrazin-2-yl)carbamoyl]-1-benzofuran-4-yl}oxy)pyrimidine-2-carboxamide
S41, N,N-dimethyl-5-({2-methyl-6-[(5-methylpyrazin-2-yl)carbamoyl]-1-benzofuran-4-yl}oxy)pyrimidine-2-carboxamide (C22 H20 N6 O4, 432.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site…
- Component
- S41
- Formula
- C22 H20 N6 O4
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
S41 in 4 structures; the first of them:
- 3S41 · Glucokinase in complex with activator and glucose · S41 A4000 · binds TYR61, VAL62, ARG63, SER64, THR65, SER69, VAL91, ILE159 and 12 more
- 4DHY · Crystal structure of human glucokinase in complex with glucose and activator · S41 A502 · binds TYR61, VAL62, ARG63, SER64, THR65, SER69, VAL91, ILE159 and 12 more
- 3S41 · Glucokinase in complex with activator and glucose · S41 A4000 · binds TYR61, VAL62, ARG63, SER64, THR65, SER69, VAL91, ILE159 and 12 more
- 4DHY · Crystal structure of human glucokinase in complex with glucose and activator · S41 A502 · binds TYR61, VAL62, ARG63, SER64, THR65, SER69, VAL91, ILE159 and 12 more
Residues it binds most
VAL 4, TYR 4, ALA 4, ILE 4, MET 4, SER 4, ARG 4, CYS 4, GLU 4, LEU 4 (residue and the binding sites it lines).
Found with
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