Ligand · 05C

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

05C, 7-(8-methylnaphthalen-1-yl)-4-[(2~{R})-2-methylpiperazin-1-yl]-2-[[(2~{S})-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5~{H}-pyrido[3,4-d]pyrimidine (C29 H38 N6 O, 486.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component: 05C
Formula: C29 H38 N6 O
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

05C in 2 structures; the first of them:

7EW9 · GDP-bound KRAS G12D in complex with TH-Z816 · 05C A302 · binds VAL9, GLY10, ASP12, ALA59, GLY60, GLU62, GLU63, TYR64 and 10 more
7EW9 · GDP-bound KRAS G12D in complex with th-Z816 · 05C A302 · binds VAL9, GLY10, ASP12, ALA59, GLY60, GLU62, GLU63, TYR64 and 10 more

Residues it binds most

ASP 4, ARG 4, GLU 4, GLY 4, TYR 4, VAL 4, GLN 4, ALA 4, HIS 4, ILE 4 (residue and the binding sites it lines).

Found with

GDP · Guanosine-5'-diphosphate
MG · Magnesium ion

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