Ligand · O8T

O8T · 5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide

O8T, 5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide (C34 H44 N6 O3, 584.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…

Component: O8T
Formula: C34 H44 N6 O3
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

O8T in 2 structures; the first of them:

6Y4W · Crystal structure of p38 in complex with SR69 · O8T A401 · binds TYR35, VAL38, ALA51, LYS53, ARG67, GLU71, LEU74, LEU75 and 17 more
6Y4W · Crystal structure of P38 in complex with SR69 · O8T A401 · binds TYR35, VAL38, ALA51, LYS53, ARG67, GLU71, LEU74, LEU75 and 17 more

Residues it binds most

LEU 2, ILE 2, ALA 2, GLY 2, HIS 2, MET 2, VAL 2, ARG 2, ASP 2, GLU 2 (residue and the binding sites it lines).

Found with

EDO · 1,2-ethanediol

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