3ISJ

Crystal structure of pantothenate synthetase from Mycobacterium tuberculosis in complex with 5-methoxy-N-(methylsulfonyl)-1H-indole-2-carboxamide

Summary for 3ISJ

Entry DOI	10.2210/pdb3isj/pdb
Related	3IMC 3IME 3IMG
Descriptor	Pantothenate synthetase, ETHANOL, GLYCEROL, ... (6 entities in total)
Functional Keywords	mycobacterium tuberculosis, pantothenate synthetase, fragment-based drug design, atp-binding, ligase, magnesium, metal-binding, nucleotide-binding, pantothenate biosynthesis
Biological source	Mycobacterium tuberculosis
Total number of polymer chains	2
Total formula weight	64323.65
Authors	Silvestre, H.L.,Hung, A.W.,Wen, S.,Ciulli, A.,Blundell, T.L.,Abell, C. (deposition date: 2009-08-26, release date: 2009-10-27, Last modification date: 2024-02-21)
Primary citation	Hung, A.W.,Silvestre, H.L.,Wen, S.,Ciulli, A.,Blundell, T.L.,Abell, C. Application of fragment growing and fragment linking to the discovery of inhibitors of Mycobacterium tuberculosis pantothenate synthetase Angew.Chem.Int.Ed.Engl., 48:8452-8456, 2009 Cited by PubMed: 19780086 DOI: 10.1002/anie.200903821 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.2 Å)

Structure validation