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Ligand · T9N

T9N · 2-[(3-hydroxyphenyl)amino]-4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]pyrimidine-5-carbonitrile

T9N, 2-[(3-hydroxyphenyl)amino]-4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]pyrimidine-5-carbonitrile (C16 H14 N6 O S, 338.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…

Component
T9N
Formula
C16 H14 N6 O S
Class
ligand
Structures
4
PDB entries
2

Binding sites

T9N in 4 structures; the first of them:

  • 4BCJ · Structure of CDK9 in complex with cyclin T and a 2-amino-4-heteroaryl- pyrimidine… · T9N A1327 · binds ILE25, PHE30, VAL33, ALA46, VAL79, PHE103, ASP104, PHE105 and 6 more
  • 4BCN · Structure of CDK2 in complex with cyclin A and a 2-amino-4-heteroaryl- pyrimidine… · T9N A1299 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, PHE82 and 10 more
  • 4BCJ · Structure of CDK9 in complex with cyclin T and a 2-amino-4-heteroaryl- pyrimidine… · T9N A1327 · binds ILE25, PHE30, VAL33, ALA46, VAL79, PHE103, ASP104, PHE105 and 6 more
  • 4BCN · Structure of CDK2 in complex with cyclin a and a 2-amino-4- heteroaryl-pyrimidine… · T9N A1299 · binds ILE10, VAL18, ALA31, LYS33, VAL64, PHE80, GLU81, PHE82 and 10 more

Residues it binds most

ASP 6, PHE 6, VAL 6, LEU 6, ALA 6, GLN 4, LYS 4, GLU 6, HIS 6, ILE 6 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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