7Q8V

Crystal structure of TTBK1 in complex with VNG2.73 (compound 42)

Summary for 7Q8V

Entry DOI	10.2210/pdb7q8v/pdb
Descriptor	Tau-tubulin kinase 1, PHOSPHATE ION, ~{N}-[4-(2-chloranylphenoxy)phenyl]-7~{H}-pyrrolo[2,3-d]pyrimidin-4-amine, ... (4 entities in total)
Functional Keywords	kinase, ttbk1, tau tubulin kinase, kinase inhibitor, structural genomics, structural genomics consortium, sgc, transferase
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	35946.78
Authors	Chaikuad, A.,Nozal, V.,Martinez, A.,Knapp, S.,Structural Genomics Consortium (SGC) (deposition date: 2021-11-11, release date: 2022-03-09, Last modification date: 2024-01-31)
Primary citation	Nozal, V.,Martinez-Gonzalez, L.,Gomez-Almeria, M.,Gonzalo-Consuegra, C.,Santana, P.,Chaikuad, A.,Perez-Cuevas, E.,Knapp, S.,Lietha, D.,Ramirez, D.,Petralla, S.,Monti, B.,Gil, C.,Martin-Requero, A.,Palomo, V.,de Lago, E.,Martinez, A. TDP-43 Modulation by Tau-Tubulin Kinase 1 Inhibitors: A New Avenue for Future Amyotrophic Lateral Sclerosis Therapy. J.Med.Chem., 65:1585-1607, 2022 Cited by PubMed: 34978799 DOI: 10.1021/acs.jmedchem.1c01942 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.13 Å)

Structure validation