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Ligand · 980

980 · (2S)-1-(4-{[2-(2-aminopyrimidin-5-yl)-7-methyl-4-(morpholin-4-yl)thieno[3,2-d]pyrimidin-6-yl]methyl}piperazin-1-yl)-2-hydroxypropan-1-one

980, (2S)-1-(4-{[2-(2-aminopyrimidin-5-yl)-7-methyl-4-(morpholin-4-yl)thieno[3,2-d]pyrimidin-6-yl]methyl}piperazin-1-yl)-2-hydroxypropan-1-one (C23 H30 N8 O3 S, 498.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
980
Formula
C23 H30 N8 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

980 in 2 structures; the first of them:

  • 3TL5 · Discovery of GDC-0980: a Potent, Selective, and Orally Available Class I… · 980 A1 · binds LYS802, MET804, ALA805, SER806, TRP812, ILE831, LYS833, ASP836 and 12 more
  • 3TL5 · Discovery of gdc-0980: a potent, selective, and orally available class I… · 980 A1 · binds LYS802, MET804, ALA805, SER806, TRP812, ILE831, LYS833, ASP836 and 12 more

Residues it binds most

ILE 2, ASP 2, LYS 2, MET 2, ALA 2, GLU 2, LEU 2, PHE 2, SER 2, THR 2 (residue and the binding sites it lines).

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