Hydride-transfer transition structure as a possible unifying redox step for decscribing the branched mechanism of glutathione reductase. Molecular-electronic antecedents

F. Iribarne; M. Paulino; O. Tapia

doi:10.1007/s002149900075

Hydride-transfer transition structure as a possible unifying redox step for decscribing the branched mechanism of glutathione reductase. Molecular-electronic antecedents

Theoretical Chemistry Accounts ◽

10.1007/s002149900075 ◽

2000 ◽

Vol 103 (6) ◽

pp. 451-462 ◽

Cited By ~ 5

Author(s):

F. Iribarne ◽

M. Paulino ◽

O. Tapia

Keyword(s):

Glutathione Reductase ◽

Hydride Transfer ◽

Transition Structure ◽

Molecular Electronic

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Transition structure and reactive complexes for hydride transfer in an isoalloxazine-nicotinamide complex. On the catalytic mechanism of glutathione reductase. An ab initio MO SCF study

Chemical Physics ◽

10.1016/0301-0104(95)00425-4 ◽

1996 ◽

Vol 204 (2-3) ◽

pp. 195-203 ◽

Cited By ~ 5

Author(s):

W. Diaz ◽

J.M. Aullo ◽

M. Paulino ◽

O. Tapia

Keyword(s):

Ab Initio ◽

Glutathione Reductase ◽

Catalytic Mechanism ◽

Hydride Transfer ◽

Transition Structure ◽

Ab Initio Mo

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Transition structure for hydride transfer to pyridinium cation from methanolate. Modeling of LADH catalyzed reaction

Journal of the American Chemical Society ◽

10.1021/ja00220a058 ◽

1988 ◽

Vol 110 (12) ◽

pp. 4046-4047 ◽

Cited By ~ 54

Author(s):

O. Tapia ◽

R. Cardenas ◽

J. Andres ◽

F. Colonna-Cesari

Keyword(s):

Hydride Transfer ◽

Transition Structure ◽

Pyridinium Cation

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ChemInform Abstract: Transition Structure for Hydride Transfer to Pyridinium Cation from Methanolate. Modeling of LADH Catalyzed Reaction

ChemInform ◽

10.1002/chin.198839313 ◽

1988 ◽

Vol 19 (39) ◽

Author(s):

O. TAPIA ◽

R. CARDENAS ◽

J. ANDRES ◽

F. COLONNA-CESARI

Keyword(s):

Hydride Transfer ◽

Transition Structure ◽

Pyridinium Cation

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On Transition Structures for Hydride Transfer Step in Enzyme Catalysis. A Comparative Study on Models of Glutathione Reductase Derived from Semiempirical, HF, and DFT Methods

The Journal of Organic Chemistry ◽

10.1021/jo960803y ◽

1996 ◽

Vol 61 (22) ◽

pp. 7777-7783 ◽

Cited By ~ 13

Author(s):

Juan Andrés ◽

Vicente Moliner ◽

Vicent S. Safont ◽

Luís R. Domingo ◽

María T. Picher

Keyword(s):

Comparative Study ◽

Glutathione Reductase ◽

Enzyme Catalysis ◽

Hydride Transfer ◽

Dft Methods ◽

Transfer Step ◽

Transition Structures

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Human erythrocyte glutathione reductase: chemical mechanism and structure of the transition state for hydride transfer

Biochemistry ◽

10.1021/bi00099a031 ◽

1991 ◽

Vol 30 (35) ◽

pp. 8702-8709 ◽

Cited By ~ 20

Author(s):

William L. Sweet ◽

John S. Blanchard

Keyword(s):

Transition State ◽

Glutathione Reductase ◽

Human Erythrocyte ◽

Hydride Transfer ◽

Chemical Mechanism

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Transition structure for hydride transfer from cyclopropene to azirinium cation

Journal of Molecular Structure THEOCHEM ◽

10.1016/0166-1280(95)04439-6 ◽

1996 ◽

Vol 363 (2) ◽

pp. 257-261

Author(s):

Luis R. Domingo ◽

M.Teresa Picher ◽

Juan Andrés

Keyword(s):

Hydride Transfer ◽

Transition Structure

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On a possible invariance of a transition structure to the effects produced by ancillary H-bonding molecules: Modeling the effects of Ser-48 in the hydride-transfer step of liver alcohol dehydrogenase

International Journal of Quantum Chemistry ◽

10.1002/(sici)1097-461x(1996)57:2<245::aid-qua11>3.0.co;2-5 ◽

1996 ◽

Vol 57 (2) ◽

pp. 245-257 ◽

Cited By ~ 5

Author(s):

R. C�rdenas ◽

J. Andr�s ◽

J. Krechl ◽

M. Campillo ◽

O. Tapia

Keyword(s):

Alcohol Dehydrogenase ◽

Hydride Transfer ◽

Transition Structure ◽

Liver Alcohol Dehydrogenase ◽

Transfer Step

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Transition structure for the hydride transfer reaction from formate anion to cyclopropenyl cation: a simple theoretical model for the reaction catalyzed by formate dehydrogenase

Chemical Physics Letters ◽

10.1016/0009-2614(92)85221-u ◽

1992 ◽

Vol 189 (4-5) ◽

pp. 395-400 ◽

Cited By ~ 20

Author(s):

O. Tapia ◽

J. Andrés ◽

R. Cardenas

Keyword(s):

Theoretical Model ◽

Formate Dehydrogenase ◽

Transfer Reaction ◽

Hydride Transfer ◽

Transition Structure ◽

Simple Theoretical Model ◽

Hydride Transfer Reaction

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Am1 and pm3 transition structure for the hydride transfer. A model of reaction catalyzed by dihydrofolate reductase

Journal of Molecular Structure THEOCHEM ◽

10.1016/0166-1280(94)03869-m ◽

1995 ◽

Vol 330 (1-3) ◽

pp. 411-416 ◽

Cited By ~ 17

Author(s):

J. Andrés ◽

V.S. Safont ◽

J.B.L. Martins ◽

A. Beltrán ◽

V. Moliner

Keyword(s):

Dihydrofolate Reductase ◽

Hydride Transfer ◽

Transition Structure

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METASTABLE ATOMS IN GASDYNAMIC JETS : LASER DIAGNOSTICS AND STUDIES FOR MOLECULAR ELECTRONIC TRANSITION LASERS

Le Journal de Physique Colloques ◽

10.1051/jphyscol:1980941 ◽

1980 ◽

Vol 41 (C9) ◽

pp. C9-299-C9-303

Author(s):

U. Brinkmann ◽

J. Kluge

Keyword(s):

Electronic Transition ◽

Laser Diagnostics ◽

Molecular Electronic ◽

Electronic Transition Lasers

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