Stepwise Simulation of 3,5-Dihydro-5-methylidene-4H-imidazol-4-one (MIO) Biogenesis in Histidine Ammonia-lyase

Biochemistry

Volumn 55, Issue 41, 2016, Pages 5854-5864

  Sánchez Murcia, Pedro A ^a,c   Bueren Calabuig, Juan A ^a,d   Camacho Artacho, Marta ^b   Cortés Cabrera, Álvaro ^a,e   Gago, Federico ^a  

^a UNIVERSITY OF ALCALÁ   (Spain)

^b Structural Biology and Biocomputing Programme   (Spain)

^c UNIVERSITY OF VIENNA   (Austria)

^d UNIVERSITY OF DUNDEE   (United Kingdom)

^e GLAXOSMITHKLINE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACIDS; AMMONIA; BACTERIA; CHAINS; CHARGE DENSITY; DEHYDRATION; FIGHTER AIRCRAFT; HYDROGEN BONDS; MOLECULAR DYNAMICS; MOLECULAR MODELING; MOLECULAR OXYGEN; MOLECULES; PROTEINS; QUANTUM THEORY; REACTION KINETICS;

BACKBONE CYCLIZATION; DENSITY FUNCTIONAL TIGHT BINDING METHOD; GREEN FLUORESCENT PROTEIN; MECHANICAL COMPRESSION; MOLECULAR DYNAMICS SIMULATIONS; NUCLEOPHILIC ATTACK; QUANTUM MECHANICS/MOLECULAR MECHANICS; SELF CONSISTENT CHARGES;

CYCLIZATION;

3,5 DIHYDRO 5 METHYLIDENE 4H IMIDAZOL 4 ONE; GLYCINE; HISTIDINE AMMONIALYASE; IMIDAZOLE DERIVATIVE; OXYGEN; SERINE; TETRAMER; TYROSINE; UNCLASSIFIED DRUG;

ARTICLE; CYCLIZATION; DENSITY FUNCTIONAL THEORY; ELECTROPHILICITY; HYDRATION; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR MECHANICS; NONHUMAN; PRIORITY JOURNAL; PSEUDOMONAS PUTIDA; QUANTUM MECHANICS; CHEMISTRY; METABOLISM; QUANTUM THEORY; X RAY CRYSTALLOGRAPHY;

CRYSTALLOGRAPHY, X-RAY; HISTIDINE AMMONIA-LYASE; IMIDAZOLES; MOLECULAR DYNAMICS SIMULATION; QUANTUM THEORY;

EID: 84991778596     PISSN: 00062960     EISSN: 15204995     Source Type: Journal    
DOI: 10.1021/acs.biochem.6b00744     Document Type: Article

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