5DTM
Crystal structure of Dot1L in complex with inhibitor CPD1 [4-(2,6-dichlorobenzoyl)-N-methyl-1H-pyrrole-2-carboxamide]
Summary for 5DTM
| Entry DOI | 10.2210/pdb5dtm/pdb |
| Descriptor | Histone-lysine N-methyltransferase, H3 lysine-79 specific, 4-(2,6-dichlorobenzoyl)-N-methyl-1H-pyrrole-2-carboxamide (3 entities in total) |
| Functional Keywords | inhibitor, complex, methyltransferase, transferase |
| Biological source | Homo sapiens (Human) |
| Cellular location | Nucleus : Q8TEK3 |
| Total number of polymer chains | 2 |
| Total formula weight | 77507.46 |
| Authors | Scheufler, C.,Be, C.,Moebitz, H.,Stauffer, F. (deposition date: 2015-09-18, release date: 2016-06-15, Last modification date: 2024-01-10) |
| Primary citation | Scheufler, C.,Mobitz, H.,Gaul, C.,Ragot, C.,Be, C.,Fernandez, C.,Beyer, K.S.,Tiedt, R.,Stauffer, F. Optimization of a Fragment-Based Screening Hit toward Potent DOT1L Inhibitors Interacting in an Induced Binding Pocket. Acs Med.Chem.Lett., 7:730-734, 2016 Cited by PubMed: 27563394DOI: 10.1021/acsmedchemlett.6b00168 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2.2 Å) |
Structure validation
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