Ligand · JKE

JKE · 2-sulfanylbenzoic acid

JKE, 2-sulfanylbenzoic acid (C7 H6 O2 S, 154.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component: JKE
Formula: C7 H6 O2 S
Class: ligand
Structures: 2
PDB entries: 2

Binding sites

JKE in 2 structures; the first of them:

6G9X · Crystal structure of a mfs transporter at 2.54 angstroem resolution · JKE A507 · binds LEU28, TYR119, LEU145, ARG280, TYR331, PHE335, PHE359, CYS362
6K4T · Crystal structure of smb-1 metallo-beta-lactamase in a complex with tsa · JKE A303 · binds HIS72, HIS74, ASP76, HIS77, GLN113, HIS150, SER175, THR177 and 2 more

Residues it binds most

HIS 1, LEU 2, PHE 2, TYR 2, ARG 2, ASP 1, CYS 1, GLN 1, SER 1, THR 1 (residue and the binding sites it lines).

Found with

BNG · nonyl beta-D-glucopyranoside
HG · Mercury (II) ion
ZN · Zinc ion
SO4 · Sulfate ion
EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid
TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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