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Ligand · 0S8

0S8 · 5-bromo-N~4~-[3-(3-methoxypropyl)-1H-pyrazol-5-yl]-N~2~-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine

0S8, 5-bromo-N~4~-[3-(3-methoxypropyl)-1H-pyrazol-5-yl]-N~2~-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine (C16 H20 Br N7 O2, 422.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
0S8
Formula
C16 H20 Br N7 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0S8 in 2 structures; the first of them:

  • 4F64 · Crystal structure of Human Fibroblast Growth Factor Receptor 1 Kinase domain in complex… · 0S8 A801 · binds LEU484, GLY485, VAL492, ALA512, LYS514, GLU531, ILE545, VAL561 and 10 more
  • 4F64 · Crystal structure of human fibroblast growth factor receptor 1 kinase domain in complex… · 0S8 A801 · binds LEU484, GLY485, VAL492, ALA512, LYS514, GLU531, ILE545, VAL561 and 10 more

Residues it binds most

ALA 4, GLU 4, GLY 4, LEU 4, VAL 4, LYS 4, ARG 4, ASN 4, ASP 4, ILE 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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