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TitleComparative Study of Ortho- and Meta-Nitrated Inhibitors of Catechol-O-Methyltransferase: Interactions with the Active Site and Regioselectivity of O-Methylation.
Journal, issue, pagesMol. Pharmacol., Vol. 70, Page 143-, Year 2006
Publish dateApr 26, 2006 (structure data deposition date)
AuthorsPalma, P.N. / Rodrigues, M.L. / Archer, M. / Bonifacio, M.J. / Loureiro, A.I. / Learmonth, D.A. / Carrondo, M.A. / Soares-Da-Silva, P.
External linksMol. Pharmacol. / PubMed:16618795
MethodsX-ray diffraction
Resolution1.6 Å
Structure data

PDB-2cl5:
Catechol-O-methyltransferase in complex with an inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

Chemicals

ChemComp-MG:
Unknown entry

ChemComp-SAM:
S-ADENOSYLMETHIONINE

ChemComp-BIE:
(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE

ChemComp-BU3:
(R,R)-2,3-BUTANEDIOL

ChemComp-MES:
2-(N-MORPHOLINO)-ETHANESULFONIC ACID / pH buffer*YM

ChemComp-HOH:
WATER

Source
  • rattus norvegicus (Norway rat)
KeywordsTRANSFERASE / ALTERNATIVE INITIATION / CATECHOLAMINE METABOLISM / NEUROTRANSMITTER DEGRADATION / CATECHOL-O-METHYLTRANSFERASE / PHOSPHORYLATION / METHYLTRANSFERASE / SIGNAL-ANCHOR / TRANSMEMBRANE / COMT INHIBITOR / MEMBRANE / MAGNESIUM / METAL-BINDING

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