Ligand · 6R0

6R0 · (3~{a}~{S},7~{a}~{R})-1-methyl-5-[4-[[5-(oxan-4-yl)-7~{H}-pyrrolo[2,3-d]pyrimidin-4-yl]amino]cyclohexyl]-3,3~{a},4,6,7,7~{a}-hexahydropyrrolo[3,2-c]pyridin-2-one

6R0, (3~{a}~{S},7~{a}~{R})-1-methyl-5-[4-[[5-(oxan-4-yl)-7~{H}-pyrrolo[2,3-d]pyrimidin-4-yl]amino]cyclohexyl]-3,3~{a},4,6,7,7~{a}-hexahydropyrrolo[3,2-c]pyridin-2-one (C25 H36 N6 O2, 452.6 g/mol), in the MolNFT structures on GenesisL1…

Component: 6R0
Formula: C25 H36 N6 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

6R0 in 2 structures; the first of them:

5K7G · IRAK4 in complex with AZ3862 · 6R0 A503 · binds MET192, GLY193, VAL200, ALA211, LYS213, GLU233, VAL246, TYR262 and 10 more
5K7G · IRAK4 in complex with AZ3862 · 6R0 A503 · binds MET192, GLY193, VAL200, ALA211, LYS213, VAL246, TYR262, VAL263 and 5 more

Residues it binds most

VAL 8, ASP 8, LEU 8, MET 8, TYR 8, SER 7, GLY 6, ALA 8, LYS 8, GLU 4 (residue and the binding sites it lines).

Found with

SO4 · Sulfate ion

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