Ligand · 03P
03P · N-{2-[4-({3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}amino)-5H-pyrrolo[3,2-d]pyrimidin-5-yl]ethyl}-3-hydroxy-3-methylbutanamide
03P, N-{2-[4-({3-chloro-4-[3-(trifluoromethyl)phenoxy]phenyl}amino)-5H-pyrrolo[3,2-d]pyrimidin-5-yl]ethyl}-3-hydroxy-3-methylbutanamide (C26 H25 Cl F3 N5 O3, 548.0 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB…
- Component
- 03P
- Formula
- C26 H25 Cl F3 N5 O3
- Class
- ligand
- Structures
- 6
- PDB entries
- 3
Binding sites
03P in 6 structures; the first of them:
- 3POZ · EGFR Kinase domain complexed with tak-285 · 03P A1023 · binds LEU718, GLY719, VAL726, ALA743, ILE744, LYS745, MET766, CYS775 and 17 more
- 3RCD · HER2 Kinase Domain Complexed with TAK-285 · 03P A9001 · binds LEU726, GLY727, SER728, GLY729, VAL734, ALA751, ILE752, LYS753 and 15 more
- 3W2O · EGFR Kinase domain T790M/L858R Mutant with TAK-285 · 03P A1101 · binds LEU718, GLY719, SER720, GLY721, PHE723, VAL726, ALA743, ILE744 and 12 more
- 3POZ · EGFR kinase domain complexed with tak-285 · 03P A1023 · binds LEU718, GLY719, VAL726, ALA743, ILE744, LYS745, MET766, CYS775 and 17 more
- 3RCD · HER2 kinase domain complexed with tak-285 · 03P A9001 · binds LEU726, GLY727, SER728, GLY729, VAL734, ALA751, ILE752, LYS753 and 15 more
- 3W2O · EGFR kinase domain T790M/L858R mutant with tak-285 · 03P A1101 · binds LEU718, GLY719, SER720, GLY721, PHE723, VAL726, ALA743, ILE744 and 12 more
Residues it binds most
LEU 8, GLY 8, ILE 8, MET 8, PHE 8, THR 6, ALA 8, ARG 6, GLN 8, LYS 8 (residue and the binding sites it lines).
Found with
- SO4 · Sulfate ion
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