Table S4.76. Fragment 76 interactions with His

Fragment 76
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 His residue via hydrogen bonds.

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

Ligand Description


  1. Ligand: ECQ
(3s)-3-[(2s)-2-amino-3-hydroxybutyl]pyrrolidin-2-one
PDB code: 2z3d.


  2. Ligand: OCQ
(3s)-3-[(2s)-2-amino-4-hydroxy-3-oxobutyl]pyrrolidin-2-one
PDB code: 2z3d.


  3. Ligand: CY6
N-((3s,6r)-6-((s,e)-4-ethoxycarbonyl-1-((s)-2-oxopyrrolidin-3-yl)but-3-en-2-ylcarbamoyl)-2,9-
dimethyl-4-oxodec-8-en-3-yl)-5-methylisoxazole-3-carboxamide
PDB code: 2alv.


  4. Ligand: NOL
N-[(benzyloxy)carbonyl]-o-(tert-butyl)-l-threonyl-3-cyclohexyl-n-[(1s)-2-hydroxy-1-{[(3s)-2-
oxopyrrolidin-3-yl]methyl}ethyl]-l-alaninamide
PDB code: 2gx4.


  5. Ligand: ROL
Rolipram
PDB code: 1ro6.