GL1X · GenesisL1 explorer

Ligand · 05I

05I · 4-[(1~{S},5~{R})-3,8-diazabicyclo[3.2.1]octan-3-yl]-7-(8-methylnaphthalen-1-yl)-2-[[(2~{S})-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5~{H}-pyrido[3,4-d]pyrimidine

05I, 4-[(1~{S},5~{R})-3,8-diazabicyclo[3.2.1]octan-3-yl]-7-(8-methylnaphthalen-1-yl)-2-[[(2~{S})-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5~{H}-pyrido[3,4-d]pyrimidine (C30 H38 N6 O, 498.7 g/mol), in the MolNFT structures on GenesisL1…

Component
05I
Formula
C30 H38 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

05I in 2 structures; the first of them:

  • 7EWB · GDP-bound KRAS G12D in complex with TH-Z835 · 05I A303 · binds GLY10, ASP12, GLY60, GLU62, GLU63, TYR64, ARG68, ASP69 and 8 more
  • 7EWB · GDP-bound KRAS G12D in complex with th-Z835 · 05I A303 · binds GLY10, ASP12, GLY60, GLU62, GLU63, TYR64, ARG68, ASP69 and 8 more

Residues it binds most

ASP 6, ARG 6, GLU 6, GLY 6, TYR 6, VAL 6, GLN 6, HIS 6, ILE 6, MET 6 (residue and the binding sites it lines).

Found with

  • GDP · Guanosine-5'-diphosphate
  • GNP · Phosphoaminophosphonic acid-guanylate ester
  • MG · Magnesium ion

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.