Ligand · 161

161 · 5-[4-(1-carboxymethyl-2-oxo-propylcarbamoyl)-benzylsulfamoyl]-2-hydroxy-benzoic acid

161, 5-[4-(1-carboxymethyl-2-oxo-propylcarbamoyl)-benzylsulfamoyl]-2-hydroxy-benzoic acid (C20 H20 N2 O9 S, 464.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component: 161
Formula: C20 H20 N2 O9 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

161 in 2 structures; the first of them:

1NMS · Caspase-3 tethered to irreversible inhibitor · 161 A1278 · binds ARG64, SER120, HIS121, GLY122, GLN161, ALA162, CYS163, TYR204 and 10 more
1NMS · Caspase-3 tethered to irreversible inhibitor · 161 A1278 · binds ARG64, SER120, HIS121, GLY122, GLN161, ALA162, CYS163, TYR204 and 10 more

Residues it binds most

SER 4, ARG 4, TRP 4, PHE 4, ALA 4, ASN 4, CYS 4, GLN 4, GLU 4, GLY 4 (residue and the binding sites it lines).

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