Molecular Orbital Study of Lactate Dehydrogenase
スポンサーリンク
概要
- 論文の詳細を見る
The mechanism of the enzymatic reaction of lactate dehydrogenase was studied from the quantum chemical point of view. The charge relay system composed of aspartate, histidine and lactate of the substrate or pyruvate enol of the inhibitor was assumed. The substrate or the inhibitor played a role as a proton donor like serine in the "charge relay system"of α-chymotrypsin. Moreover arginine 171 for the assumed charge relay system was very significant in order to lower the potential barrier of the proton transfer from the substrate or the inhibitor to histidine 195. Last the significance of the HOMOLUMO interaction between the substrate or the inhibitor and nicotinamide in NAD^+was shown.
- 社団法人日本薬学会の論文
- 1977-07-25
著者
-
梅山 秀明
School of Pharmaceutical Sciences, Kitasato University
-
梅山 秀明
School Of Pharmaceutical Sciences Kitasato University
-
中川 節子
School of Pharmaceutical Sciences, Kitasato University
-
永田 親義
Biophysics Division, National Cancer Center Research Institute
-
中川 節子
北里大学薬学部
-
中川 節子
School Of Pharmaceutical Sciences Kitasato University
-
永田 親義
国立がんセンター研究所生物物理部
関連論文
- Synthesis of Human Renin Inhibitory Peptides, Angiotensinogen Transition-State Analogs Containing a Retro-Inverso Amide Bond
- Synthesis and Structure-Activity Relationships of Human Renin Inhibitors Designed from Angiotensinogen Transition State
- Hydrophobic Effect on the Protein-Ligand Interaction; Hydrophobic Field-Effect Index and Hydrophobic Correlation Index
- Structure-Activity Relationship of Fluorine-Containing Renin Inhibitory Peptides Based upon the Tertiary Structure of Human Renin
- NEW HUMAN RENIN INHIBITORY PEPTIDES : ANGIOTENSINOGEN TRANSITION-STATE ANALOGUES CONTAINING NOVEL LEU-VAL REPLACEMENT AND A RETRO-INVERSO AMIDE BOND
- A NEW METHOD FOR CALCULATING HYDROPHOBIC INTERACTION ENERGY IN THE BIOLOGICAL SYSTEM
- Correlation between Molecular Orbital Distributions in Drug-Receptor Interaction : Diels-Alder Reaction Systems and Dihydrofolate Reductase System(Physical,Chemical)
- Reproduction of ab Initio Electrostatic Potential with Classical Fractional Point Charges(Physical,Chemical)
- Electrostatic Interaction Energy and Solvent Accessibility in the Methotrexate-Reduced Nicotinamide Adenine Dinucleotide Phosphate-Dihydrofolate Reductase Ternary Complex(Medicinal Chemistry,Chemical)
- 薬物-受容体相互作用のグラフィック表現とドラッグデザインへの応用 (構造活性相関とドラッグデザイン)
- Electrostatic Potential Images of Drugs Targetting Dopamine Receptors
- A Molecular Orbital Study on Tetranactin-NH_4+ Complex
- A Molecular Orbital Study on the n-π^* Cotton Effect of ε-Caprolactam
- Molecular Orbital Study of Lactate Dehydrogenase
- Purification and Properties of Z Protein from Rabbit and Rat Liver
- In Vitro Binding of Sulfobromophthalein to Cytoplasmic Protein from Liver, Kidney, and Small Intestinal Mucosa of Rat and Rabbit
- A Molecular Orbital Study on the Effects of Substituents on the Proton Transfer from Ser-195 to His-57 in the Hydrolysis of α-Chymotrypsin
- Computer Screening and Visulization of Hydrophobic Core of Protein
- ELECTROSTATIC FORCES IN THE INHIBITION OF DIHYDROFOLATE REDUCTASE BY METHOTREXATE. A FIELD POTENTIAL STUDY
- CHARGE STATE OF HIS 57-ASP 102 COUPLE IN β-TRYPSIN : A MOLECULAR ORBITAL STUDY
- Molecular Orbital Study of Proton Transfer Energetics in the Active Site of Papain by Using Methanethiol-Imidazole-Formic Acid Complex as a Model
- Energy Decomposition Analyses of Diborane
- Molecular Orbital Study on the Structure and Barrier to Internal Rotation of Phosphine-Borane
- A Molecular Orbital Study on the Zinc-Water-Glu 270 System in Carboxypeptidase A
- Simulation of the Enzymatic Reaction of Dogfish M_4 Lactate Dehydrogenase : A Molecular Orbital Study on the Reactivity of Pyruvate
- Effects of the Hydrogen Bond between His 57 and Asp 102 on the Lone Pair Molecular Orbital of Nitrogen of His 57 in Serine Proteases
- Molecular Orbital Studies on the CH_3CN-BH_3,HCN-BH_3,CH_3NC-BH_3 and HNC-BH_3 Complexes
- Proton Migration in Proton Cryptate : A Molecular Orbital Study on a Proton Cryptate Model
- A Molecular Orbital Study on the (CH_3)_2O-BH_3 Donor-Acceptor Complex
- The Molecular Orbital Study on the Role of Hydrogen Bonding System in the Active Site of Serine Proteases
- A Molecular Orbital Study on the Approach of Hydride Ion to NAD^+ as a Coenzyme
- Oxidation Reaction of Carcinogenic 4-Hydroxyaminoquinoline 1-Oxide
- Electron Spin Resonance Study on the Photoinduced Radicals from Related Compounds to Carcinogenic 4-Nitroquinoline 1-Oxide
- Electron Spin Resonance Study on the Photoinduced Radicals from Carcinogenic 4-Nitroquinoline 1-Oxide
- Adsorption of Benzoic Acid Derivatives by Carbon Black from Aqueous Solution and Related Phenomena
- A Molecular Orbital Study on the Ternary Complex of Tetranactin, NH^+_4 and SCN^-
- A ab Initio Molecular Orbital Study of Molecular Interactions between Formic Acid and Ammonia
- Simulation of the Charge Relay Structure in Ribonuclease A
- セリンプロテアーゼの分子動力学
- Estimation of Hydrophobicity Based on the Solvent-Accessible Surface Area of Molecules
- A Molecular Orbital Study on the Side Chain Structures of Tyrosine and Phenylalanine
- A Molecular Orbital Study on the Complex between Aspartic Acid and Histidine in the Charge Relay Structure
- Ab Initio Molecular Orbital Studies on the Aspirin Solvolysis and Ester Hydrolysis
- Molecular Orbital Studies on Serine, Cysteine, and Modified Proteases
- 生物学的応用 (福井謙一とフロンティア軌導理論) -- (フロンティア軌道理論の解説)
- 電荷移動と消光機作ならびに生物活性との関係について : 生体物理
- 突然変異の量子生物学的一考察 : 生体物理
- Effects of Third Component on Hydrophobic and Hydrophilic Moities of Tryptophan in Aqueous Solution. Approach to Understanding of Denaturation of Globular Protein
- Effect of Third Component on Water Structure around Tryptophan in Aqueous Solution
- Mechanism of Adsorption of Phenols by Carbon Black from Aqueous Solution
- Analysis of Solubility Properties of L-Tryptophan in Aqueous Solution based on the Effects of Third Component on Optical Rotatory Dispersion and on Adsorption by Carbon Black
- 放射線生物作用の量子化学的考察 : II. DNAレベルにおける放射線増感効果 : 生体物理
- N-Hydroxylation Enzymes of Carcinogenic Aminoazo Dyes:Possible Involvement of Cytochrome P-448
- 日米癌協力プログラム"化学発癌部門"の「多環芳香族炭化水素の発癌機構と突然変異機構に関する会議」印象記(学会見聞記)
- Binding of 6-oxybenzo〔α〕pyrene radical with DNA and polynucleotides(Communication)
- チトクロ-ムP-450と発癌物質 (チトクロ-ムP-450)
- 量子化学の構造活性相関への応用 (薬物の構造活性相関--ドラッグデザインと作用機作研究への指針)
- Molecular Orbital Study on a Chlorine Anion Cryptate
- The Origin of the Internal Rotation Barrier of Borane Compounds
- Energy Decomposition Analysis of Borazane at the Molecular Orbital Level : Origin of the Internal Rotation Barrier of H_3X-YH_3
- A Molecular Orbital Study on the Solvolysis of Aspirin Derivatives and Acyl-α-chymotrypsin
- がんと化学(化学への招待)
- 発がんにおけるフリ-ラジカル機構-2-
- 発がんにおけるフリ-ラジカル機構-1-
- がん研究は化学者に何を期待するか (新春質問箱)
- 量子化学, 量子生物学, 量子薬理学国際会議(キエフ)出席印象記
- P. Daudel and R. Daudel: Chemical Carcinogenesis and Molecular Biology, Interscience Publisilers, New York, London, Sydney, 158頁, 15×23cm, 2,800円.
- 放射生物作用の量子化学的考察 : 色素増感突然変異 : 生体物理
- 7p-H-3 生体内電荷移動と生物活性
- タイトル無し