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Ligand · T1T

T1T · 7-(3-(trifluoromethyl)-1H-pyrazol-4yl)-3,8,10,11-tetrahydropyrazolo[4,3-f]thiopyrano[3,4-c]quinoline 9-oxide

T1T, 7-(3-(trifluoromethyl)-1H-pyrazol-4yl)-3,8,10,11-tetrahydropyrazolo[4,3-f]thiopyrano[3,4-c]quinoline 9-oxide (C17 H12 F3 N5 O S, 391.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
T1T
Formula
C17 H12 F3 N5 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

T1T in 2 structures; the first of them:

  • 7B7S · CDK2/cyclin A2 in complex with 3H-pyrazolo[4,3-f]quinoline-based derivative HSD1368 · T1T A301 · binds ILE10, GLY11, GLU12, GLY13, THR14, VAL18, ALA31, LYS33 and 9 more
  • 7B7S · CDK2/CYCLIN A2 in complex with 3H-PYRAZOLO[4,3-F]QUINOLINE-based derivative HSD1368 · T1T A301 · binds ILE10, GLY11, GLU12, GLY13, THR14, VAL18, ALA31, LYS33 and 9 more

Residues it binds most

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

Found with

  • NO3 · Nitrate ion
  • SO4 · Sulfate ion
  • SGM · Monothioglycerol

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