7UE5
PANK3 complex structure with compound PZ-3741
Summary for 7UE5
Entry DOI | 10.2210/pdb7ue5/pdb |
Descriptor | Pantothenate kinase 3, 6-[4-({4-[(2R)-1,1,1-trifluoropropan-2-yl]phenyl}acetyl)piperazin-1-yl]pyridazine-3-carbonitrile, 6-[4-({4-[(2S)-1,1,1-trifluoropropan-2-yl]phenyl}acetyl)piperazin-1-yl]pyridazine-3-carbonitrile, ... (6 entities in total) |
Functional Keywords | pank, substrate, complex, transferase, pantothenate kinase, inhibitor, activator |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 1 |
Total formula weight | 43463.05 |
Authors | White, S.W.,Yun, M.,Lee, R.E. (deposition date: 2022-03-21, release date: 2023-03-29, Last modification date: 2024-10-09) |
Primary citation | Tangallapally, R.,Subramanian, C.,Yun, M.K.,Edwards, A.,Sharma, L.K.,Yang, L.,Creed, K.,Wang, J.,Jackowski, S.,Rock, C.O.,White, S.W.,Lee, R.E. Development of Brain Penetrant Pyridazine Pantothenate Kinase Activators. J.Med.Chem., 67:14432-14442, 2024 Cited by PubMed: 39136313DOI: 10.1021/acs.jmedchem.4c01211 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.63 Å) |
Structure validation
Download full validation report