Ligand · I6T
I6T · (3R,4R)-1-[7-(8-chloronaphthalen-1-yl)-2-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]-3-hydroxypiperidine-4-carbaldehyde
I6T, (3R,4R)-1-[7-(8-chloronaphthalen-1-yl)-2-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl]-3-hydroxypiperidine-4-carbaldehyde (C29 H34 Cl N5 O3, 536.1 g/mol), in the MolNFT structures on GenesisL1…
- Component
- I6T
- Formula
- C29 H34 Cl N5 O3
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
I6T in 2 structures; the first of them:
- 7TLE · Crystal Structure of small molecule beta-lactone 1 covalently bound to K-Ras(G12S) · I6T A202 · binds VAL9, GLY10, ALA11, SER12, LYS16, THR58, ALA59, GLY60 and 14 more
- 7TLE · Crystal structure of small molecule beta-lactone 1 covalently bound to K-RAS(G12S) · I6T A202 · binds VAL9, GLY10, ALA11, SER12, LYS16, THR58, ALA59, GLY60 and 14 more
Residues it binds most
ALA 2, ARG 2, ASP 2, GLN 2, GLU 2, GLY 2, TYR 2, VAL 2, HIS 2, ILE 2 (residue and the binding sites it lines).
Found with
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