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TitleInhibitors of Acetyltransferase Domain of N-Acetylglucosamine-1-Phosphate-Uridyltransferase/ Glucosamine-1-Phosphate-Acetyltransferase (Glmu). Part 1: Hit to Lead Evaluation of a Novel Arylsulfonamide Series.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 22, Page 1510-, Year 2012
Publish dateNov 30, 2011 (structure data deposition date)
AuthorsGreen, O.M. / McKenzie, A.R. / Shapiro, A.B. / Otterbein, L. / Ni, H. / Patten, A. / Stokes, S. / Albert, R. / Kawatkar, S. / Breed, J.
External linksBioorg. Med. Chem. Lett. / PubMed:22297115
MethodsX-ray diffraction
Resolution2 - 2.2 Å
Structure data

PDB-4aa7:
E.coli GlmU in complex with an antibacterial inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-4aaw:
S.pneumoniae GlmU in complex with an antibacterial inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

PDB-4ac3:
S.pneumoniae GlmU in complex with an antibacterial inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-R82:
N-(2,4-dimethoxy-5-{[(2R)-2-methyl-2,3-dihydro-1H-indol-1-yl]sulfonyl}phenyl)acetamide

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-R84:
4-{[1-(2-{[({5-[(3-carboxypropanoyl)amino]-2,4-dimethoxyphenyl}sulfonyl)amino]methyl}phenyl)piperidin-4-yl]methoxy}-4-oxobutanoic acid

ChemComp-R83:
N-{2,4-DIMETHOXY-5-[(2-PIPERIDIN-1-YLBENZYL)sulfamoyl]phenyl}acetamide

Source
  • escherichia coli (E. coli)
  • streptococcus pneumoniae (bacteria)
KeywordsTRANSFERASE / ACETYL TRANSFERASE / TRANSFERASE-INHIBITOR COMPLEX / TRANSFERASE INHIBITOR COMPLEX

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