7SLV

Vanin-1 complexed with Compound 3

Summary for 7SLV

• Entry DOI: 10.2210/pdb7slv/pdb
• Descriptor: Pantetheinase, beta-D-mannopyranose-(1-3)-[beta-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, beta-D-mannopyranose-(1-3)-beta-D-mannopyranose-(1-6)-[beta-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... (7 entities in total)
• Functional Keywords: pantetheine, sbdd, pyrimdine carboxamide, hydrolase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 56605.59

Authors

Vajdos, F.F. (deposition date: 2021-10-25, release date: 2022-01-12, Last modification date: 2022-01-26)

• Primary citation: Casimiro-Garcia, A.,Allais, C.,Brennan, A.,Choi, C.,Dower, G.,Farley, K.A.,Fleming, M.,Flick, A.,Frisbie, R.K.,Hall, J.,Hepworth, D.,Jones, H.,Knafels, J.D.,Kortum, S.,Lovering, F.E.,Mathias, J.P.,Mohan, S.,Morgan, P.M.,Parng, C.,Parris, K.,Pullen, N.,Schlerman, F.,Stansfield, J.,Strohbach, J.W.,Vajdos, F.F.,Vincent, F.,Wang, H.,Wang, X.,Webster, R.,Wright, S.W.; Discovery of a Series of Pyrimidine Carboxamides as Inhibitors of Vanin-1.; J.Med.Chem., 65:757-784, 2022; PubMed: 34967602; DOI: 10.1021/acs.jmedchem.1c01849

Experimental method

X-RAY DIFFRACTION (2.13 Å)