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Ligand · CGS

CGS · N-hydroxy-2(R)-[[(4-methoxyphenyl)sulfonyl](3-picolyl)amino]-3-methylbutanamide hydrochloride

CGS, N-hydroxy-2(R)-[[(4-methoxyphenyl)sulfonyl](3-picolyl)amino]-3-methylbutanamide hydrochloride (C18 H23 N3 O5 S, 393.5 g/mol), in the MolNFT structures on GenesisL1: bound in 8 records (4 PDB entries). Every binding site with its…

Component
CGS
Formula
C18 H23 N3 O5 S
Class
ligand
Structures
8
PDB entries
4

Binding sites

CGS in 8 structures; the first of them:

  • 1JIZ · Crystal Structure Analysis of human Macrophage Elastase MMP-12 · CGS A998 · binds GLY80, ILE81, LEU82, ALA83, HIS84, LEU115, THR116, HIS119 and 7 more
  • 2W0D · Does a Fast Nuclear Magnetic Resonance Spectroscopy- and X-Ray Crystallography Hybrid… · CGS A1273 · binds GLY179, ILE180, LEU181, ALA182, HIS183, LEU214, THR215, HIS218 and 8 more
  • 3AYK · Catalytic fragment of human fibroblast collagenase complexed with cgs-27023A, NMR… · CGS A173 · binds GLY79, ASN80, LEU81, ALA82, HIS83, ARG114, VAL115, HIS118 and 7 more
  • 4AYK · Catalytic fragment of human fibroblast collagenase complexed with cgs-27023A, NMR, 30… · CGS A173 · binds GLY79, ASN80, LEU81, ALA82, HIS83, ARG114, VAL115, HIS118 and 7 more
  • 1JIZ · Crystal structure analysis of human macrophage elastase mmp- 12 · CGS A998 · binds GLY80, ILE81, LEU82, ALA83, HIS84, LEU115, THR116, HIS119 and 7 more
  • 2W0D · Does a fast nuclear magnetic resonance spectroscopy- and X-ray crystallography hybrid… · CGS A1273 · binds GLY179, ILE180, LEU181, ALA182, HIS183, LEU214, THR215, HIS218 and 8 more
  • 3AYK · Catalytic fragment of human fibroblast collagenase complexed with cgs- 27023A, NMR… · CGS A173 · binds GLY79, ASN80, LEU81, ALA82, HIS83, ARG114, VAL115, HIS118 and 7 more
  • 4AYK · Catalytic fragment of human fibroblast collagenase complexed with cgs- 27023A, NMR, 30… · CGS A173 · binds GLY79, ASN80, LEU81, ALA82, HIS83, ARG114, VAL115, HIS118 and 7 more

Residues it binds most

HIS 16, LEU 16, THR 12, GLY 16, TYR 16, ALA 16, ILE 12, PRO 16, VAL 16, ARG 4 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • NA · Sodium ion
  • CL · Chloride ion
  • ACT · Acetate ion

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