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Crystal structure of SmyD3 in complex with covalent inhibitor 4
Descriptor:	Histone-lysine N-methyltransferase SMYD3, S-ADENOSYLMETHIONINE, ZINC ION, ...
Authors:	Baburajendran, N, Anna E, J.
Deposit date:	2017-10-11
Release date:	2018-10-17
Last modified:	2019-07-10
Method:	X-RAY DIFFRACTION (2.135 Å)
Cite:	Discovery of Irreversible Inhibitors Targeting Histone Methyltransferase, SMYD3. Acs Med.Chem.Lett., 10, 2019

Crystal structure of SmyD3 in complex with covalent inhibitor 5
Descriptor:	Histone-lysine N-methyltransferase SMYD3, S-ADENOSYLMETHIONINE, ZINC ION, ...
Authors:	Baburajendran, N, Joy, J.
Deposit date:	2018-10-10
Release date:	2019-08-14
Last modified:	2024-03-27
Method:	X-RAY DIFFRACTION (2.351 Å)
Cite:	Discovery of Irreversible Inhibitors Targeting Histone Methyltransferase, SMYD3. Acs Med.Chem.Lett., 10, 2019

Solution structure of thrombin binding aptamer G-quadruplex bound a self-adaptive small molecule with rotated ligands
Descriptor:	11,13-bis(fluoranyl)-8-(1-methyl-3-pyridin-2-yl-imidazol-2-yl)-8-(1-methyl-3-pyridin-2-yl-imidazol-2-yl)-7$l^{4}-aza-8$l^{4}-platinatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaene, TBA G4 DNA (5'-D(GPGPTPTPGPGPTPGPTPGPGPTPTPGP*G)-3')
Authors:	Liu, W, Zhu, B.C, Mao, Z.W.
Deposit date:	2021-08-11
Release date:	2022-09-28
Last modified:	2024-05-15
Method:	SOLUTION NMR
Cite:	Solution structure of a thrombin binding aptamer complex with a non-planar platinum(ii) compound. Chem Sci, 13, 2022

Fragment-based Lead Discovery of Indazole-based Compounds as AXL Kinase Inhibitors
Descriptor:	3-[4-[6-chloranyl-5-[[(3R)-pyrrolidin-3-yl]amino]-1H-indazol-3-yl]pyrazol-1-yl]benzenecarbonitrile, Tyrosine-protein kinase Mer
Authors:	Anantharajan, J, Baburajendran, N.
Deposit date:	2021-01-19
Release date:	2021-10-13
Last modified:	2023-11-29
Method:	X-RAY DIFFRACTION (3.146 Å)
Cite:	Fragment-based lead discovery of indazole-based compounds as AXL kinase inhibitors. Bioorg.Med.Chem., 49, 2021