Ligand · VPJ

VPJ · N~2~-(4-fluorophenyl)-6-{[(5-{[(oxolan-2-yl) methyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine

VPJ, N~2~-(4-fluorophenyl)-6-{[(5-{[(oxolan-2-yl) methyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,3,5-triazine-2,4-diamine (C17 H19 F N8 O S2, 434.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component: VPJ
Formula: C17 H19 F N8 O S2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

VPJ in 2 structures; the first of them:

7JYQ · JAK2 JH2 in complex with JAK020 · VPJ A902 · binds LEU551, ILE559, LEU579, VAL610, GLN626, GLU627, PHE628, VAL629 and 7 more
7JYQ · JAK2 JH2 in complex with JAK020 · VPJ A902 · binds LEU551, ILE559, LEU579, VAL610, GLN626, GLU627, PHE628, VAL629 and 7 more

Residues it binds most

LEU 2, LYS 2, PHE 2, VAL 2, GLN 2, GLU 2, GLY 2, ILE 2, SER 2, THR 2 (residue and the binding sites it lines).

Found with

GOL · Glycerol

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