5LQU

Crystal Structure of COMT in complex with N-[(E)-3-[(2R,3S,4R,5R)-5-[6-(ethylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]prop-2-enyl]-5-(4-fluorophenyl)-2,3-dihydroxybenzamide

Summary for 5LQU

• Entry DOI: 10.2210/pdb5lqu/pdb
• Descriptor: Catechol O-methyltransferase, N-[(E)-3-[(2R,3S,4R,5R)-5-(6-ethylaminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]prop-2-enyl]-5-(4-fluorophenyl)-2,3-dihydroxy-benzamide, MAGNESIUM ION, ... (6 entities in total)
• Functional Keywords: methyltransferase, neurotransmitter degradation, transferase
• Biological source: Rattus norvegicus (Norway Rat)
• Cellular location: Isoform 2: Cytoplasm. Isoform 1: Cell membrane; Single-pass type II membrane protein; Extracellular side: P22734
• Total number of polymer chains: 2
• Total formula weight: 51010.08

Authors

Ehler, A.,Lerner, C.,Ellermann, M.,Rudolph, M.G. (deposition date: 2016-08-17, release date: 2016-10-05)

• Primary citation: Lerner, C.,Ellermann, M.,Rudolph, M.G.; Crystal Structure of COMT in complex with N-[(E)-3-[(2R,3S,4R,5R)-5-[6-(ethylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]prop-2-enyl]-5-(4-fluorophenyl)-2,3-dihydroxybenzamide; To be published,

Experimental method

X-RAY DIFFRACTION (1.8 Å)