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Ligand · BAG

BAG · N-[(E)-2-amino-1-(3-{[amino(imino)methyl]amino}propyl)-2-hydroxyvinyl]benzamide

BAG, N-[(E)-2-amino-1-(3-{[amino(imino)methyl]amino}propyl)-2-hydroxyvinyl]benzamide (C13 H19 N5 O2, 277.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
BAG
Formula
C13 H19 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

BAG in 2 structures; the first of them:

  • 1WDA · Crystal structure of human peptidylarginine deiminase type4 (PAD4) in complex with… · BAG A801 · binds TRP347, GLN349, ASP350, ARG372, ARG374, GLY408, VAL469, HIS471 and 7 more
  • 1WDA · Crystal structure of human peptidylarginine deiminase TYPE4 (PAD4) in complex with… · BAG A801 · binds TRP347, GLN349, ASP350, ARG372, ARG374, GLY408, VAL469, HIS471 and 7 more

Residues it binds most

ARG 2, ASP 2, GLY 2, HIS 2, ALA 2, ASN 2, GLN 2, GLU 2, TRP 2, VAL 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • SO4 · Sulfate ion

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