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TitleA small molecule inhibitor of Nicotinamide N-methyltransferase for the treatment of metabolic disorders.
Journal, issue, pagesSci Rep, Vol. 8, Page 3660-3660, Year 2018
Publish dateOct 10, 2017 (structure data deposition date)
AuthorsKannt, A. / Rajagopal, S. / Kadnur, S.V. / Suresh, J. / Bhamidipati, R.K. / Swaminathan, S. / Hallur, M.S. / Kristam, R. / Elvert, R. / Czech, J. ...Kannt, A. / Rajagopal, S. / Kadnur, S.V. / Suresh, J. / Bhamidipati, R.K. / Swaminathan, S. / Hallur, M.S. / Kristam, R. / Elvert, R. / Czech, J. / Pfenninger, A. / Rudolph, C. / Schreuder, H. / Chandrasekar, D.V. / Mane, V.S. / Birudukota, S. / Shaik, S. / Zope, B.R. / Burri, R.R. / Anand, N.N. / Thakur, M.K. / Singh, M. / Parveen, R. / Kandan, S. / Mullangi, R. / Yura, T. / Gosu, R. / Ruf, S. / Dhakshinamoorthy, S.
External linksSci Rep / PubMed:29483571
MethodsX-ray diffraction
Resolution1.99 - 2.49 Å
Structure data

PDB-5yjf:
Co-crystal structure of Human Nicotinamide N-methyltransferase (NNMT) with small molecule analog of Nicotinamide
Method: X-RAY DIFFRACTION / Resolution: 2.49 Å

PDB-5yji:
Co-crystal structure of Mouse Nicotinamide N-methyltransferase (NNMT) with small molecule analog of Nicotinamide
Method: X-RAY DIFFRACTION / Resolution: 1.99 Å

Chemicals

ChemComp-SAH:
S-ADENOSYL-L-HOMOCYSTEINE

ChemComp-8WO:
6-methoxy-1-methyl-2H-pyridine-3-carboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
  • mus musculus (house mouse)
KeywordsTRANSFERASE / NNMT / MNA / T2D

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