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TitleStructural basis of O-methylation of (2-heptyl-)1-hydroxyquinolin-4(1H)-one and related compounds by the heterocyclic toxin methyltransferase Rv0560c of Mycobacterium tuberculosis.
Journal, issue, pagesJ. Struct. Biol., Vol. 213, Page 107794-107794, Year 2021
Publish dateJan 7, 2021 (structure data deposition date)
AuthorsSartor, P. / Denkhaus, L. / Gerhardt, S. / Einsle, O. / Fetzner, S.
External linksJ. Struct. Biol. / PubMed:34506908
MethodsX-ray diffraction
Resolution1.04 - 1.8 Å
Structure data

PDB-7bgg:
Crystal structure of the heterocyclic toxin methyltransferase from Mycobacterium tuberculosis
Method: X-RAY DIFFRACTION / Resolution: 1.04 Å

PDB-7ndm:
Crystal structure of the heterocyclic toxin methyltransferase from Mycobacterium tuberculosis with bound substrate 4-hydroxyisoquinolin-1(2H)-one
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

PDB-7nmk:
Crystal structure of the heterocyclic toxin methyltransferase from Mycobacterium tuberculosis with bound methylation product 1-methoxyquinolin-4(1H)-one
Method: X-RAY DIFFRACTION / Resolution: 1.204 Å

PDB-7noy:
Crystal structure of the heterocyclic toxin methyltransferase from Mycobacterium tuberculosis in complex with substrate 1-hydroxyquinolin-4(1H)-one
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-SAH:
S-ADENOSYL-L-HOMOCYSTEINE

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-U8N:
4-oxidanyl-2~{H}-isoquinolin-1-one

ChemComp-MLI:
MALONATE ION

ChemComp-UJH:
1-methoxy-4-oxoquinoline

ChemComp-FMT:
FORMIC ACID

ChemComp-UK5:
1-oxidanylquinolin-4-one

Source
  • mycobacterium tuberculosis (strain atcc 25618 / h37rv) (bacteria)
  • mycobacterium tuberculosis h37rv (bacteria)
KeywordsTRANSFERASE / Methyltransferase / HQNO-detoxification / SAM-dependent / 1 / 4-dihydroxyisoqunioline / Rv0560c

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