Ligand · JKA
JKA · (1S,4R,5S,6R)-2-(methylsulfonyl)-2-azabicyclo[3.3.1]nonane-4,6-diol
JKA, (1S,4R,5S,6R)-2-(methylsulfonyl)-2-azabicyclo[3.3.1]nonane-4,6-diol (C9 H17 N O4 S, 235.3 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the…
- Component
- JKA
- Formula
- C9 H17 N O4 S
- Class
- ligand
- Structures
- 3
- PDB entries
- 2
Binding sites
JKA in 3 structures; the first of them:
- 5QFR · PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with… · JKA A401 · binds GLY14, SER15, TRP16, ALA17, ASP265
- 5QFR · Pandda analysis group deposition -- crystal structure of PTP1B in complex with… · JKA A401 · binds GLY14, SER15, TRP16, ALA17, ASP265
- 5QFW · Pandda analysis group deposition -- crystal structure of PTP1B in complex with… · JKA A401 · binds GLY14, SER15, TRP16, ALA17, ALA264, ASP265
Residues it binds most
ASP 5, ALA 3, GLY 3, SER 3, TRP 3, ARG 2, GLU 2, LEU 2, VAL 2 (residue and the binding sites it lines).
Found with
- TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol
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