Ligand · X9P

X9P · 3-tert-butyl-N-[(1S)-6-{2-[5-methyl-1-(propan-2-yl)-1H-pyrazol-4-yl]-1H-imidazo[4,5-b]pyridin-7-yl}-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,4-oxadiazole-5-carboxamide

X9P, 3-tert-butyl-N-[(1S)-6-{2-[5-methyl-1-(propan-2-yl)-1H-pyrazol-4-yl]-1H-imidazo[4,5-b]pyridin-7-yl}-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,4-oxadiazole-5-carboxamide (C30 H34 N8 O2, 538.7 g/mol), in the MolNFT structures on GenesisL1…

Component: X9P
Formula: C30 H34 N8 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

X9P in 2 structures; the first of them:

7KXN · BTK1 soaked with compound 26 · X9P A701 · binds LEU408, GLY409, THR410, GLY411, GLN412, PHE413, VAL416, ALA428 and 17 more
7KXN · BTK1 soaked with compound 26 · X9P A701 · binds LEU408, GLY409, THR410, GLY411, GLN412, PHE413, VAL416, ALA428 and 17 more

Residues it binds most

GLY 2, LEU 2, ALA 2, ASP 2, SER 2, THR 2, TYR 2, VAL 2, ASN 2, CYS 2 (residue and the binding sites it lines).

Found with

DMS · Dimethyl sulfoxide

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