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Ligand · TJF

TJF · 4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]-2-{[3-(morpholin-4-ylcarbonyl)phenyl]amino}pyrimidine-5-carbonitrile

TJF, 4-[4-methyl-2-(methylamino)-1,3-thiazol-5-yl]-2-{[3-(morpholin-4-ylcarbonyl)phenyl]amino}pyrimidine-5-carbonitrile (C21 H21 N7 O2 S, 435.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
TJF
Formula
C21 H21 N7 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

TJF in 2 structures; the first of them:

  • 4BCQ · Structure of CDK2 in complex with cyclin A and a 2-amino-4-heteroaryl- pyrimidine… · TJF A1296 · binds ILE10, GLY11, VAL18, ALA31, VAL64, PHE80, GLU81, PHE82 and 7 more
  • 4BCQ · Structure of CDK2 in complex with cyclin a and a 2-amino-4- heteroaryl-pyrimidine… · TJF A1296 · binds ILE10, GLY11, VAL18, ALA31, VAL64, PHE80, GLU81, PHE82 and 7 more

Residues it binds most

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

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