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Ligand · WBG

WBG · 3-(cyclohex-1-en-1-yl)-6-(4-methoxyphenyl)-2-phenyl-5-[(pyridin-2-yl)amino]pyrazolo[1,5-a]pyrimidin-7(4H)-one

WBG, 3-(cyclohex-1-en-1-yl)-6-(4-methoxyphenyl)-2-phenyl-5-[(pyridin-2-yl)amino]pyrazolo[1,5-a]pyrimidin-7(4H)-one (C30 H27 N5 O2, 489.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
WBG
Formula
C30 H27 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

WBG in 2 structures; the first of them:

  • 7KCC · Crystal structure of human methionine adenosyltransferase 2A (MAT2A) in complex with SAM… · WBG A408 · binds GLY16, THR17, PHE18, LEU19, PHE20, GLN190, ASP191, ARG192 and 7 more
  • 7KCC · Crystal structure of human methionine adenosyltransferase 2A (MAT2A) in complex with SAM… · WBG A408 · binds GLY16, THR17, PHE18, LEU19, PHE20, GLN190, ASP191, ARG192 and 7 more

Residues it binds most

GLY 2, ARG 2, PHE 2, ALA 2, ASP 2, GLN 2, LEU 2, THR 2, TRP 2, VAL 2 (residue and the binding sites it lines).

Found with

  • SAM · S-adenosylmethionine
  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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