4NYG

Crystal structure of the E. coli thiM riboswitch in complex with thiamine

Summary for 4NYG

Entry DOI	10.2210/pdb4nyg/pdb
Related	4NYA 4NYB 4NYC 4NYD
Descriptor	thiM TPP riboswitch, 3-(4-AMINO-2-METHYL-PYRIMIDIN-5-YLMETHYL)-5-(2-HYDROXY-ETHYL)-4-METHYL-THIAZOL-3-IUM, MAGNESIUM ION, ... (4 entities in total)
Functional Keywords	fragment-based drug discovery, riboswitch, rna
Biological source	Escherichia coli
Total number of polymer chains	1
Total formula weight	27272.09
Authors	Warner, K.D.,Homan, P.,Weeks, K.M.,Smith, A.G.,Abell, C.,Ferre-D'Amare, A.R. (deposition date: 2013-12-10, release date: 2014-06-04, Last modification date: 2023-09-20)
Primary citation	Warner, K.D.,Homan, P.,Weeks, K.M.,Smith, A.G.,Abell, C.,Ferre-D'Amare, A.R. Validating Fragment-Based Drug Discovery for Biological RNAs: Lead Fragments Bind and Remodel the TPP Riboswitch Specifically. Chem.Biol., 21:591-595, 2014 Cited by PubMed: 24768306 DOI: 10.1016/j.chembiol.2014.03.007 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (3.05 Å)

Structure validation