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Ligand · MTW

MTW · Hydroxy(oxo)(3-{[(2Z)-4-[3-(1H-1,2,4-triazol-1-ylmethyl)phenyl]pyrimidin-2(5H)-ylidene]amino}phenyl)ammonium

MTW, Hydroxy(oxo)(3-{[(2Z)-4-[3-(1H-1,2,4-triazol-1-ylmethyl)phenyl]pyrimidin-2(5H)-ylidene]amino}phenyl)ammonium (C19 H15 N7 O2, 373.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site…

Component
MTW
Formula
C19 H15 N7 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

MTW in 4 structures; the first of them:

  • 2C5X · Differential Binding Of Inhibitors To Active And Inactive Cdk2 Provides Insights For Drug… · MTW A1297 · binds ILE10, GLU12, GLY13, VAL18, ALA31, LYS33, GLU51, PHE80 and 11 more
  • 2C5Y · Differential binding of inhibitors to active and inactive CDK2 provides insights for drug… · MTW A1298 · binds ILE10, GLY11, GLU12, GLY13, GLY16, VAL18, ALA31, LYS33 and 14 more
  • 2C5X · Differential binding of inhibitors to active and inactive CDK2 provides insights for drug… · MTW A1297 · binds ILE10, GLU12, GLY13, VAL18, ALA31, LYS33, GLU51, PHE80 and 11 more
  • 2C5Y · Differential binding of inhibitors to active and inactive CDK2 provides insights for drug… · MTW A1298 · binds ILE10, GLY11, GLU12, GLY13, GLY16, VAL18, ALA31, LYS33 and 14 more

Residues it binds most

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

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