Crystal structure of E.COLI phosphopantetheine adenylyltransferase (PPAT/COAD) in complex with N-((1,3-dimethyl-1H-pyrazol-5-YL)METHYL)- 5-methyl-1H-IMIDAZO[4,5-B]PYRIDIN-2-amine

Structure

x-ray diffraction · 1 distinct chain.

Ligands and binding sites

• CWP · N-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]-5-methyl-3H-imidazo[4,5-b]pyridin-2-amine · ligand · 2 copies · chains A, B
• POP · Pyrophosphate 2- · ligand · 2 copies · chains A, B
• SO4 · Sulfate ion · ion · 4 copies · chains A, B
• PEG · Di(hydroxyethyl)ether · additive · 3 copies · chains A, B
• DMS · Dimethyl sulfoxide · additive · 3 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

• 6B7C · Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex… · the same entry in another collection · chain A against A, TM-score 1.00
• P0A6I6 · AlphaFold monomer V2.0 prediction for phosphopantetheine adenylyltransferase (P0A6I6) · a predicted model of the same protein · chain B against A, TM-score 0.98

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• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt P0A6I6
• Elsewhere: RCSB PDB 6B7C · PDBe 6B7C · UniProt P0A6I6