8K9X

Crystal structure of plasmodium LysRS complexing with ASP3026 derived LysRS inhibitor 5 (ADKI5)

Summary for 8K9X

Entry DOI	10.2210/pdb8k9x/pdb
Descriptor	Lysine--tRNA ligase, (2~{S})-2,6-bis(azanyl)-~{N}-[3-[2-[[4-[(2,5-dimethoxyphenyl)amino]-1,3,5-triazin-2-yl]amino]phenyl]sulfonylpropyl]hexanamide, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ... (4 entities in total)
Functional Keywords	lysyl-trna synthetase, ligase
Biological source	Plasmodium falciparum CAMP/Malaysia
Total number of polymer chains	2
Total formula weight	121098.10
Authors	Zhou, J.,Xia, M.,Yang, G.,Li, P.,Fang, P. (deposition date: 2023-08-01, release date: 2024-06-26, Last modification date: 2024-07-03)
Primary citation	Zhou, J.,Xia, M.,Huang, Z.,Qiao, H.,Yang, G.,Qian, Y.,Li, P.,Zhang, Z.,Gao, X.,Jiang, L.,Wang, J.,Li, W.,Fang, P. Structure-guided conversion from an anaplastic lymphoma kinase inhibitor into Plasmodium lysyl-tRNA synthetase selective inhibitors. Commun Biol, 7:742-742, 2024 Cited by PubMed: 38890421 DOI: 10.1038/s42003-024-06455-4 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.35 Å)

Structure validation