Ligand · PK5

PK5 · 2-ethyl-~{N}-[[4-[4-[5-methyl-2,4-bis(oxidanylidene) pyrimidin-1-yl]piperidin-1-yl]phenyl]methyl]-1,2,3,5, 6,7,8,8~{A}-octahydroimidazo[1,2-a]pyridine-3-carboxamide

PK5, 2-ethyl-~{N}-[[4-[4-[5-methyl-2,4-bis(oxidanylidene) pyrimidin-1-yl]piperidin-1-yl]phenyl]methyl]-1,2,3,5, 6,7,8,8~{A}-octahydroimidazo[1,2-a]pyridine-3-carboxamide (C27 H37 Cl N6 O3, 529.1 g/mol), in the MolNFT structures on…

Component: PK5
Formula: C27 H37 Cl N6 O3
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

PK5 in 2 structures; the first of them:

6YT1 · Mtb TMK crystal structure in complex with compound 26 · PK5 A301 · binds ASP9, PHE36, PRO37, TYR39, ALA49, LEU52, PHE70, ARG74 and 8 more
6YT1 · Mtb tmk crystal structure in complex with compound 26 · PK5 A301 · binds ASP9, PHE36, PRO37, LEU52, PHE70, ARG74, ARG95, SER99 and 3 more

Residues it binds most

TYR 4, ARG 4, PHE 4, ASP 4, LEU 4, ASN 4, PRO 4, SER 4, GLU 3, GLN 2 (residue and the binding sites it lines).

Found with

CIT · Citric acid

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