5HNE
X-RAY CRYSTAL STRUCTURE OF HUMAN MITOCHONDRIAL BRANCHED CHAIN AMINOTRANSFERASE (BCATM) COMPLEXED WITH A 2-ARYL BENZIMIDAZOLE COMPOUND AND AN INTERNAL ALDIMINE LINKED PLP COFACTOR
Summary for 5HNE
Entry DOI | 10.2210/pdb5hne/pdb |
Related | 5CR5 |
Descriptor | Branched-chain-amino-acid aminotransferase, mitochondrial, PYRIDOXAL-5'-PHOSPHATE, 1-[(1R,3S)-3-{[(5-bromothiophen-2-yl)carbonyl]amino}cyclohexyl]-N-methyl-2-(pyridin-2-yl)-1H-benzimidazole-5-carboxamide, ... (7 entities in total) |
Functional Keywords | fold type iv, transferase |
Biological source | Homo sapiens (Human) |
Cellular location | Isoform A: Mitochondrion. Isoform B: Cytoplasm: O15382 |
Total number of polymer chains | 2 |
Total formula weight | 85743.60 |
Authors | Somers, D.O. (deposition date: 2016-01-18, release date: 2016-05-04, Last modification date: 2024-05-01) |
Primary citation | Deng, H.,Zhou, J.,Sundersingh, F.,Messer, J.A.,Somers, D.O.,Ajakane, M.,Arico-Muendel, C.C.,Beljean, A.,Belyanskaya, S.L.,Bingham, R.,Blazensky, E.,Boullay, A.B.,Boursier, E.,Chai, J.,Carter, P.,Chung, C.W.,Daugan, A.,Ding, Y.,Herry, K.,Hobbs, C.,Humphries, E.,Kollmann, C.,Nguyen, V.L.,Nicodeme, E.,Smith, S.E.,Dodic, N.,Ancellin, N. Discovery and Optimization of Potent, Selective, and in Vivo Efficacious 2-Aryl Benzimidazole BCATm Inhibitors. Acs Med.Chem.Lett., 7:379-384, 2016 Cited by PubMed: 27096045DOI: 10.1021/acsmedchemlett.5b00389 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.04 Å) |
Structure validation
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