Table S1.119. Fragment 119 interactions with Asp

Fragment 119
Listed below are the ligands in the PDB that contain the chemical fragment shown on the left and which interact via this fragment with the side chain of a Asp residue via hydrogen bonds.

The PDB codes are hyperlinked to a schematic LIGPLOT diagram in PDBsum.

Ligand Description


  1. Ligand: 15A
(2z,3r,4s,5r,6r)-2-[(2-aminoethyl)imino]-6-(hydroxymethyl)piperidine-3,4,5-triol
PDB code: 2vqt.


  2. Ligand: 17B
(2z,3r,4s,5r,6r)-2-[(4-aminobutyl)imino]-6-(hydroxymethyl)piperidine-3,4,5-triol
PDB code: 2vr4.


  3. Ligand: DMJ
1-deoxymannojirimycin
PDB code: 1hxk.


  4. Ligand: GHR
[[(3s,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)piperidin-2-ylidene]amino] n-(4-
chlorophenyl)carbamate
PDB code: 3d52.


  5. Ligand: GOX
(2s,3s,4r,5r)-6-(hydroxyamino)-2-(hydroxymethyl)-2,3,4,5-tetrahydropyridine-3,4,5-triol
PDB code: 3d51.


  6. Ligand: NBV
(2r,3r,4r,5s)-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol
PDB code: 2v3d.


  7. Ligand: NOJ
1-deoxynojirimycin
PDB codes: 1i75, 2pwd.


  8. Ligand: NOY
(2r,3s,4r,5r)-5-(hydroxymethyl)piperidine-2,3,4-triol
PDB code: 2vqu.


  9. Ligand: NOZ
(2s,3s,4r,5r)-5-(hydroxymethyl)piperidine-2,3,4-triol
PDB code: 2vl4.


  10. Ligand: 9MR
(3r,4r,5r)-3-hydroxy-5-(hydroxymethyl)piperidin-4-yl beta-d-glucopyranoside
PDB code: 2oyk.


  11. Ligand: IFG
(2r,3r,4s,5r)-2-acetamido-3,4-dihydroxy-5-hydroxymethyl-piperidine
PDB code: 1jak.


  12. Ligand: IFM
5-hydroxymethyl-3,4-dihydroxypiperidine
PDB codes: 1ocn, 1up2.