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Ligand · 66T

66T · N-{3-[2-(3,5-dimethoxyphenyl)ethyl]-1H-pyrazol-5-yl}-4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]benzamide

66T, N-{3-[2-(3,5-dimethoxyphenyl)ethyl]-1H-pyrazol-5-yl}-4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]benzamide (C26 H33 N5 O3, 463.6 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries). Every binding site with its…

Component
66T
Formula
C26 H33 N5 O3
Class
ligand
Structures
8
PDB entries
4

Binding sites

66T in 8 structures; the first of them:

  • 4RWJ · Crystal Structure of FGFR1 (C488A, C584S) in complex with AZD4547… · 66T A801 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 14 more
  • 4RWK · Crystal structure of V561M FGFR1 gatekeeper mutation (C488A, C584S, V561M) in complex… · 66T A801 · binds LEU484, GLY490, VAL492, ALA512, LYS514, ILE545, MET561, GLU562 and 11 more
  • 4V05 · FGFR1 in complex with AZD4547. · 66T A1769 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 16 more
  • 4WUN · Structure of FGFR1 in complex with AZD4547 (N-{3-[2-(3,5-DIMETHOXYPHENYL)ETHYL]-1H-PYRAZOL… · 66T A801 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 14 more
  • 4RWJ · Crystal structure of FGFR1 (C488A, C584S) in complex with AZD4547 (N… · 66T A801 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 14 more
  • 4RWK · Crystal structure of V561M FGFR1 gatekeeper mutation (C488A, C584S, V561M) in complex… · 66T A801 · binds LEU484, GLY490, VAL492, ALA512, LYS514, ILE545, MET561, GLU562 and 11 more
  • 4V05 · FGFR1 in complex with AZD4547. · 66T A1769 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 16 more
  • 4WUN · Structure of FGFR1 in complex with AZD4547 (N-{3-[2-(3,5… · 66T A801 · binds LEU484, GLY485, PHE489, VAL492, ALA512, LYS514, GLU531, MET535 and 14 more

Residues it binds most

ALA 16, GLU 16, VAL 16, GLY 16, LEU 16, LYS 16, PHE 14, MET 16, ASP 16, ILE 16 (residue and the binding sites it lines).

Found with

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

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