6WFG

Crystal structure of human Naa50 in complex with an inhibitor (compound 3) identified using DNA encoded library technology

Summary for 6WFG

• Entry DOI: 10.2210/pdb6wfg/pdb
• Related: 6WF3 6WF5
• Descriptor: N-alpha-acetyltransferase 50, COENZYME A, (2S)-N-[(2S)-3-[1-(3-tert-butyl-1-methyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]-1-(methylamino)-1-oxopropan-2-yl]-6-oxopiperidine-2-carboxamide, ... (4 entities in total)
• Functional Keywords: n-alpha-acetyltransferase 50, inhibitor complex, dna encoded library, coa, transferase, transferase-inhibitor complex, transferase/inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 3
• Total formula weight: 62440.90

Authors

Greasley, S.E.,Feng, J.,Deng, Y.-L.,Stewart, A.E. (deposition date: 2020-04-03, release date: 2020-07-01, Last modification date: 2024-03-06)

• Primary citation: Kung, P.P.,Bingham, P.,Burke, B.J.,Chen, Q.,Cheng, X.,Deng, Y.L.,Dou, D.,Feng, J.,Gallego, G.M.,Gehring, M.R.,Grant, S.K.,Greasley, S.,Harris, A.R.,Maegley, K.A.,Meier, J.,Meng, X.,Montano, J.L.,Morgan, B.A.,Naughton, B.S.,Palde, P.B.,Paul, T.A.,Richardson, P.,Sakata, S.,Shaginian, A.,Sonnenburg, W.K.,Subramanyam, C.,Timofeevski, S.,Wan, J.,Yan, W.,Stewart, A.E.; Characterization of SpecificN-alpha-Acetyltransferase 50 (Naa50) Inhibitors Identified Using a DNA Encoded Library.; Acs Med.Chem.Lett., 11:1175-1184, 2020; PubMed: 32550998; DOI: 10.1021/acsmedchemlett.0c00029

Experimental method

X-RAY DIFFRACTION (2.16 Å)