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Ligand · 4TM

4TM · N-{(1R)-2-(hydroxyamino)-2-oxo-1-[4-(thiophen-3-yl)phenyl]ethyl}-2,2-dimethylpropanamide

4TM, N-{(1R)-2-(hydroxyamino)-2-oxo-1-[4-(thiophen-3-yl)phenyl]ethyl}-2,2-dimethylpropanamide (C17 H20 N2 O3 S, 332.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues…

Component
4TM
Formula
C17 H20 N2 O3 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

4TM in 4 structures; the first of them:

  • 4ZX5 · X-ray crystal structure of PfA-M1 in complex with hydroxamic acid-based inhibitor 10q · 4TM A1102 · binds GLU319, ALA320, VAL459, GLY460, ALA461, MET462, GLU463, ARG489 and 9 more
  • 4ZY0 · X-ray crystal structure of PfA-M17 in complex with hydroxamic acid-based inhibitor 10q · 4TM A1001 · binds LYS374, ASP379, LYS386, SER391, MET392, LEU395, PHE398, ASP399 and 13 more
  • 4ZX5 · X-ray crystal structure of pfa-M1 in complex with hydroxamic acid- based inhibitor 10Q · 4TM A1102 · binds GLU319, ALA320, VAL459, GLY460, ALA461, MET462, GLU463, ARG489 and 9 more
  • 4ZY0 · X-ray crystal structure of pfa-M17 in complex with hydroxamic acid- based inhibitor 10Q · 4TM A1001 · binds LYS374, ASP379, LYS386, SER391, MET392, LEU395, PHE398, ASP399 and 13 more

Residues it binds most

ASP 24, LEU 24, GLY 26, MET 26, LYS 24, PHE 24, THR 24, ALA 26, GLU 26, SER 18 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • GOL · Glycerol
  • MG · Magnesium ion
  • CO3 · Carbonate ion
  • SO4 · Sulfate ion
  • 1PE · Pentaethylene glycol
  • DMS · Dimethyl sulfoxide

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