Structure of PDB 8owb Chain B

Receptor sequence
>8owbB (length=224) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence]
HHDMAGVKALVTAGGTREPLDPVRFIGNRSSGKQGYAVARVLAQRGADVT
LIAGNTAGLIDPAGVEMVHIGSATQLRDAVSKHAPDANVLVMAAAVADFR
PAHVAAAKIKKGASEPSSIDLVRNDDVLAGAVRARADGQLPNMRAIVGFA
AETDVLFHARAKLERKGCDLLVVNAVGENRAFEVDHNDGWLLSADGTESA
LEHGSKTLMATRIVDSIAAFLKSQ
3D structure
PDB8owb Development of new inhibitors against M. tuberculosis CoaBC using a fragment based approach.
ChainB
Resolution2.25 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 4.1.1.36: phosphopantothenoylcysteine decarboxylase.
6.3.2.5: phosphopantothenate--cysteine ligase (CTP).
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 CTP B K293 K294 K110 K111
BS02 CTP B M275 A277 V279 D281 D308 D309 V310 F332 K350 K354 M92 A94 V96 D98 D125 D126 V127 F149 K162 K166
External links
PDB RCSB:8owb, PDBe:8owb, PDBj:8owb
PDBsum8owb
PubMed
UniProtA0QWT2|COABC_MYCS2 Coenzyme A biosynthesis bifunctional protein CoaBC (Gene Name=coaBC)

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