Structurally different ferrocene peptides I-VI exhibit considerable conformational differences. This study has explored the structural properties of VII [Y-AA-Fca-OMe; Y = di-tert-butyl dicarbonate (Boc), acetyl (Ac); AA = L-Ala, D-Ala; Fca = 1Ј-aminoferrocene-1-carboxylic acid] with an exchanged sequence of constituent amino acids relative to VI (Y-Fca-AA-OMe; Y = Boc, Ac; AA = L-Ala, D-Ala). The ferrocene peptides VII were obtained by coupling C-protected Fca with Boc-L-Ala-OH and Boc-D-Ala-OH, respectively. The Boc protecting groups of the obtained conjugates Boc-AA-Fca-OMe (2a, AA = L-Ala; 2b, AA = D-Ala) were converted to sterically less demanding Ac groups to give Ac-AA-Fca-1820 Avance 300 MHz spectrometer in CDCl 3 solutions with Me 4 Si as the internal standard. Double resonance experiments (COSY, NOESY, and HMBC) were performed in order to assist in signal assignment. CD spectra were recorded using a Jasco-810 spectropolarimeter in CH 3 CN. Molar ellipticity coefficients, [θ], are in degrees, concentration, c, is given in molL -1 , and path length, l, is given in cm, to give units for [θ] of deg cm 2 dmol -1 . Computational Details:The starting geometries of 2a and 3a were generated by the MacroModel v9.8 [26] molecular modeling program using several different search methods and force fields. The conformers were fully optimized at the B3LYP/LanL2DZ level of theory. [23] The most stable were reoptimized in chloroform (using IEF-PCM to describe implicit solvent effects) with the B3LYP method and 6-311+G(d,p) basis set. [24] Iron was modeled using the ECP set LanL2DZ. Quantum mechanical calculations were performed with Gaussian 09, v.A.02. [27] Molecules were visualized using GaussView [28] and Chem 3D (CambridgeSoft, Cambridge, MA) programs. The topological analysis of the selected compounds was performed with the AIM2000 program. [29] Boc-AA-Fca-OMe (2a/2b): The syntheses of 2a and 2b were performed according to our recent paper: [9] the fully protected ferrocene amino acid Boc-Fca-OMe [5] (1) was N-deprotected by gaseous HCl in EtOAc to give the hydrochloride salt, which was treated with NEt 3 and coupled with Boc-AA-OH (AA = l-, d-Ala, previously activated by using EDC and HOBt). After standard workup and TLC-purification, Boc-l-Ala-Fca-OMe (2a) and Boc-d-Ala-Fca-OMe (2b) were obtained as orange resins.
Taspase 1 is an N-terminal threonine protease implicated in leukemia and other cancers. Despite intensive efforts in recent years, only a limited number of Taspase 1 inhibitors are currently available, and they lack general applicability. Here we present a novel class of Taspase 1 inhibitors based on a peptidyl succinimidyl peptide motif. These inhibitors were obtained from the substrate cleavage sequence and mechanistic considerations involving the previously proposed asparaginase-type cleavage mechanism. We anticipate that this class of Taspase 1 inhibitor will find wide application in further biochemical and structural studies, for example for better investigating the molecular details of the unusual enzymatic cleavage mechanism of Taspase 1.
Bolest međukralježničnog diska čest je uzrok ozljede leđne moždine i motorne disfunkcije te se najčešće javlja u grudno-slabinskom segmentu kralježnice. Retrospektivnim istraživanjem u razdoblju od sedam godina obuhvaćena su 104 slučaja pasa s grudno-slabinskim (GS) sindromom liječenih na Klinici za kirurgiju, ortopediju i oftalmologiju Veterinarskog fakulteta Sveučilišta u Zagrebu. Većina pasa imala je akutnu kliničku sliku s visokim stupnjem neurološkog deficita. Francuski buldog bio je najčešći hondrodistrofični tip pasmine u koje se javljao GS sindrom dok je njemački ovčar bio najbrojniji u nehondrodistrofičnom tipu pasmine. GS sindrom u većem broju javljao se u muških jedinki. Ekstruzija diska u oba tipa pasmine javljala se u području T12-T13 i T13-L1 međukralježničnog prostora. Podatci o oporavku poznati su za 61,53 % pacijenata od čega je 70,44 % pacijenata postiglo zadovoljavajući oporavak. Nad svim pacijentima u provedenom istraživanju kao operacijska tehnika koristila se bilateralna mini hemilaminektomija izvedena od strane istog operatera. U 30 % pacijenata neovisno o nalazu mijelografije, materijal diska uočen je s obje strane međukralježničnog prostora zbog čega je opravdano razmotriti primjenu bilateralne mini-hemilaminektomije kao metodu izbora pri liječenju pasa s GS sindromom. Ovi rezultati će koristiti u budućim istraživanjima GS sindroma te će doprinijeti u njegovoj dijagnostici i liječenju.
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