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Ligand · SAV

SAV · N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

SAV, N~4~-(3-methyl-1H-indazol-6-yl)-N~2~-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine (C21 H22 N6 O3, 406.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within…

Component
SAV
Formula
C21 H22 N6 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

SAV in 4 structures; the first of them:

  • 3CJF · Crystal structure of VEGFR2 in complex with a 3,4,5-trimethoxy aniline containing… · SAV A1167 · binds LEU838, GLY839, VAL846, ALA864, VAL897, VAL914, GLU915, PHE916 and 7 more
  • 4O78 · Crystal structure of the first bromodomain of human BRD4 in complex with GW612286X · SAV A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LEU92, LEU94, TYR97 and 5 more
  • 3CJF · Crystal structure of VEGFR2 in complex with a 3,4,5-trimethoxy aniline containing… · SAV A1167 · binds LEU838, GLY839, VAL846, ALA864, VAL897, VAL914, GLU915, PHE916 and 7 more
  • 4O78 · Crystal structure of the first bromodomain of human BRD4 in complex with GW612286X · SAV A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LEU92, LEU94, TYR97 and 5 more

Residues it binds most

LEU 4, VAL 4, PHE 4, ASN 4, CYS 4, GLY 2, TYR 2, ALA 2, ASP 2, CSO 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • PGE · Triethylene glycol

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