7O2B
X-RAY STRUCTURE OF SMYD3 in complex with benzodiazepine-type inhibitor 6
Summary for 7O2B
Entry DOI | 10.2210/pdb7o2b/pdb |
Descriptor | Histone-lysine N-methyltransferase SMYD3, (2S)-N-butyl-1-(2-fluorophenyl)carbonyl-2-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide, ZINC ION, ... (5 entities in total) |
Functional Keywords | smyd3; methyl transferase, transferase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 50170.23 |
Authors | Steuber, H. (deposition date: 2021-03-30, release date: 2021-07-07, Last modification date: 2024-05-01) |
Primary citation | Gradl, S.,Steuber, H.,Weiske, J.,Szewczyk, M.M.,Schmees, N.,Siegel, S.,Stoeckigt, D.,Christ, C.D.,Li, F.,Organ, S.,Abbey, M.,Kennedy, S.,Chau, I.,Trush, V.,Barsyte-Lovejoy, D.,Brown, P.J.,Vedadi, M.,Arrowsmith, C.,Husemann, M.,Badock, V.,Bauser, M.,Haegebarth, A.,Hartung, I.V.,Stresemann, C. Discovery of the SMYD3 Inhibitor BAY-6035 Using Thermal Shift Assay (TSA)-Based High-Throughput Screening. Slas Discov, 26:947-960, 2021 Cited by PubMed: 34154424DOI: 10.1177/24725552211019409 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.03 Å) |
Structure validation
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