2agw: Difference between revisions

From Proteopedia
Jump to navigationJump to search
OCA (talk | contribs)
New page: left|200px<br /><applet load="2agw" size="450" color="white" frame="true" align="right" spinBox="true" caption="2agw, resolution 1.450Å" /> '''Crystal structure o...
 
OCA (talk | contribs)
No edit summary
Line 1: Line 1:
[[Image:2agw.gif|left|200px]]<br /><applet load="2agw" size="450" color="white" frame="true" align="right" spinBox="true"  
[[Image:2agw.gif|left|200px]]<br /><applet load="2agw" size="350" color="white" frame="true" align="right" spinBox="true"  
caption="2agw, resolution 1.450&Aring;" />
caption="2agw, resolution 1.450&Aring;" />
'''Crystal structure of tryptamine-reduced aromatic amine dehydrogenase (AADH) from Alcaligenes faecalis in complex with tryptamine'''<br />
'''Crystal structure of tryptamine-reduced aromatic amine dehydrogenase (AADH) from Alcaligenes faecalis in complex with tryptamine'''<br />


==Overview==
==Overview==
We present an atomic-level description of the reaction chemistry of an, enzyme-catalyzed reaction dominated by proton tunneling. By solving, structures of reaction intermediates at near-atomic resolution, we have, identified the reaction pathway for tryptamine oxidation by aromatic amine, dehydrogenase. Combining experiment and computer simulation, we show, proton transfer occurs predominantly to oxygen O2 of Asp(128)beta in a, reaction dominated by tunneling over approximately 0.6 angstroms. The role, of long-range coupled motions in promoting tunneling is controversial. We, show that, in this enzyme system, tunneling is promoted by a short-range, motion modulating proton-acceptor distance and no long-range coupled, motion is required.
We present an atomic-level description of the reaction chemistry of an enzyme-catalyzed reaction dominated by proton tunneling. By solving structures of reaction intermediates at near-atomic resolution, we have identified the reaction pathway for tryptamine oxidation by aromatic amine dehydrogenase. Combining experiment and computer simulation, we show proton transfer occurs predominantly to oxygen O2 of Asp(128)beta in a reaction dominated by tunneling over approximately 0.6 angstroms. The role of long-range coupled motions in promoting tunneling is controversial. We show that, in this enzyme system, tunneling is promoted by a short-range motion modulating proton-acceptor distance and no long-range coupled motion is required.


==About this Structure==
==About this Structure==
2AGW is a [http://en.wikipedia.org/wiki/Protein_complex Protein complex] structure of sequences from [http://en.wikipedia.org/wiki/Alcaligenes_faecalis Alcaligenes faecalis] with TSS as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [http://en.wikipedia.org/wiki/Aralkylamine_dehydrogenase Aralkylamine dehydrogenase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.4.99.4 1.4.99.4] Full crystallographic information is available from [http://ispc.weizmann.ac.il/oca-bin/ocashort?id=2AGW OCA].  
2AGW is a [http://en.wikipedia.org/wiki/Protein_complex Protein complex] structure of sequences from [http://en.wikipedia.org/wiki/Alcaligenes_faecalis Alcaligenes faecalis] with <scene name='pdbligand=TSS:'>TSS</scene> as [http://en.wikipedia.org/wiki/ligand ligand]. Active as [http://en.wikipedia.org/wiki/Aralkylamine_dehydrogenase Aralkylamine dehydrogenase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.4.99.4 1.4.99.4] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2AGW OCA].  


==Reference==
==Reference==
Line 16: Line 16:
[[Category: Basran, J.]]
[[Category: Basran, J.]]
[[Category: Hothi, P.]]
[[Category: Hothi, P.]]
[[Category: Johannissen, L.O.]]
[[Category: Johannissen, L O.]]
[[Category: Leys, D.]]
[[Category: Leys, D.]]
[[Category: Masgrau, L.]]
[[Category: Masgrau, L.]]
[[Category: Mulholland, A.J.]]
[[Category: Mulholland, A J.]]
[[Category: Ranaghan, K.E.]]
[[Category: Ranaghan, K E.]]
[[Category: Roujeinikova, A.]]
[[Category: Roujeinikova, A.]]
[[Category: Scrutton, N.S.]]
[[Category: Scrutton, N S.]]
[[Category: Sutcliffe, M.J.]]
[[Category: Sutcliffe, M J.]]
[[Category: TSS]]
[[Category: TSS]]
[[Category: oxidoreductase]]
[[Category: oxidoreductase]]


''Page seeded by [http://ispc.weizmann.ac.il/oca OCA ] on Wed Nov 21 08:06:55 2007''
''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 16:27:21 2008''