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Literature summary extracted from

  • Ouellet, H.; Kells, P.; Ortiz De Montellano, P.; Podust, L.
    Reverse type I inhibitor of Mycobacterium tuberculosis CYP125A1 (2011), Bioorg. Med. Chem. Lett., 21, 332-337.
    View publication on PubMedView publication on EuropePMC

Crystallization (Commentary)

EC Number Crystallization (Comment) Organism
1.14.15.29 hanging drop vapor diffusion method, using 2.0 M ammonium sulfate, 0.1 M bis-Tris (pH 5.5) and 0.5 M NaCl (truncated enzyme C429L in complex with inhibitor) or 0.1 M ammonium acetate, 0.1 M bis-Tris (pH 5.5) and 17% PEG 10000, or 2.0 M ammonium sulfate and 0.1 M Tris HCl pH 8.5 (truncated enzyme C429L without any ligand) Mycobacterium tuberculosis

Protein Variants

EC Number Protein Variants Comment Organism
1.14.15.29 C429L the modification affect neither the binding nor the catalytic properties of the enzyme Mycobacterium tuberculosis

Inhibitors

EC Number Inhibitors Comment Organism Structure
1.14.15.29 alpha-[(4-methylcyclohexyl)carbonyl amino]-N-4-pyridinyl-1H-indole-3-propanamide LP10, 30% inhibition at 0.2 mM Mycobacterium tuberculosis

Organism

EC Number Organism UniProt Comment Textmining
1.14.15.29 Mycobacterium tuberculosis P9WPP1
-
-
1.14.15.29 Mycobacterium tuberculosis H37Rv P9WPP1
-
-

Substrates and Products (Substrate)

EC Number Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
1.14.15.29 cholest-4-en-3-one + 2 reduced ferredoxin [iron-sulfur] cluster + 2 H+ + O2
-
Mycobacterium tuberculosis 26-hydroxycholest-4-en-3-one + 2 oxidized ferredoxin [iron-sulfur] cluster + H2O
-
?
1.14.15.29 cholest-4-en-3-one + 2 reduced ferredoxin [iron-sulfur] cluster + 2 H+ + O2
-
Mycobacterium tuberculosis H37Rv 26-hydroxycholest-4-en-3-one + 2 oxidized ferredoxin [iron-sulfur] cluster + H2O
-
?

Synonyms

EC Number Synonyms Comment Organism
1.14.15.29 CYP125A1
-
Mycobacterium tuberculosis

Cofactor

EC Number Cofactor Comment Organism Structure
1.14.15.29 NADH
-
Mycobacterium tuberculosis