4G5Y

Crystal Structure of Mycobacterium tuberculosis Pantothenate synthetase in a ternary complex with ATP and N,N-DIMETHYLTHIOPHENE-3-SULFONAMIDE

Summary for 4G5Y

Entry DOI	10.2210/pdb4g5y/pdb
Related	3COV 3COW 3COY 3COZ 4EF6 4EFK
Descriptor	Pantothenate synthetase, ADENOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ... (7 entities in total)
Functional Keywords	drug design, fragment-based, ligase, pantothenate biosynthesis, ligase-ligase inhibitor complex, ligase/ligase inhibitor
Biological source	Mycobacterium tuberculosis
Total number of polymer chains	2
Total formula weight	65147.60
Authors	Ciulli, A.,Silvestre, H.L.,Blundell, T.L.,Abell, C. (deposition date: 2012-07-18, release date: 2013-07-03, Last modification date: 2023-09-13)
Primary citation	Silvestre, H.L.,Blundell, T.L.,Abell, C.,Ciulli, A. Integrated biophysical approach to fragment screening and validation for fragment-based lead discovery. Proc.Natl.Acad.Sci.USA, 110:12984-12989, 2013 Cited by PubMed: 23872845 DOI: 10.1073/pnas.1304045110 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.8 Å)

Structure validation