Browsing by Subject "ligand"
Now showing items 21-33 of 33
-
Article
Photochemistry of an azido-functionalized cryptand: Controlling the reactivity of an extremely long-lived singlet aryl nitrene by complexation to alkali cations
(2005)Photolysis of the cryptand 1, bearing an intraannular azido substituent, results in a complex photochemistry. Low-temperature photolysis yields the triplet nitrene 32, which has been characterized by EPR spectroscopy. Small ...
-
Article
Probing the ligand recognition and discrimination environment of the globin-coupled oxygen sensor protein YddV by FTIR and time-resolved step-scan FTIR spectroscopy
(2015)YddV is a newly discovered signal transducer heme protein that recognizes O2 and CO. Structural differences in the ligand-bound heme complex in YddV reflect variations in catalytic regulation by O2 and CO. Time-resolved ...
-
Article
Proteus and the design of ligand binding sites
(2016)This chapter describes the organization and use of Proteus, a multitool computational suite for the optimization of protein and ligand conformations and sequences, and the calculation of pKα shifts and relative binding ...
-
Article
Recognition of ribonuclease A by 3′-5′-pyrophosphate-linked dinucleotide inhibitors: A molecular dynamics/continuum electrostatics analysis
(2007)The proteins of the pancreatic ribonuclease A (RNase A) family catalyze the cleavage of the RNA polymer chain. The development of RNase inhibitors is of significant interest, as some of these compounds may have a therapeutic ...
-
Article
The role of the cross-link His-Tyr in the functional properties of the binuclear center in cytochrome c oxidase
(2002)Resonance Raman and Fourier transform infrared spectroscopies have been used to study the aa3-type cytochrome c oxidase and the Y280H mutant from Paracoccus denitrificans. The stability of the binuclear center in the absence ...
-
Article
A single-chain magnet based on linear [MnIII2MnII] units
(2014)The synthesis, structural characterization and magnetic properties of a 1D coordination polymer based on a linear mixed valent [MnIII2MnII] repeating unit are described. It displays single-chain magnet (SCM) behaviour with ...
-
Article
Symmetric and asymmetric dinuclear manganese(IV) complexes possessing a [MnIV2(μ-O)2(μ-O2 CME)3+ core and terminal Cl- ligands
(2003)The synthesis of new dinuclear manganese(IV) complexes possessing the [MnIV2(μ-O)2(μ-O2C Me)]3+ core and containing halide ions as terminal ligands is reported, [Mn2O2(O2CMe)Cl2 (bpy)2]2[MnCl4] (1
-
Article
Synthesis, structure, magnetic properties and aqueous solution characterization of p-hydroquinone and phenol iminodiacetate copper(ii) complexes
(2008)The reaction of Cu2+ acetate monohydrate with 2-[N,N′-bis(carboxymethyl)aminomethyl]-4-carboxyphenol (H 4cacp), 2-[N,N-bis(carboxymethyl)aminomethyl]hydroquinone (H 4cah) and the dinucleating 2,5-bis[N,N-bis(carboxymethy ...
-
Article
Synthesis, structure, magnetic properties and aqueous solution characterization of p-hydroquinone and phenol iminodiacetate copper(ii) complexes
(2008)The reaction of Cu2+ acetate monohydrate with 2-[N,N′-bis(carboxymethyl)aminomethyl]-4-carboxyphenol (H 4cacp), 2-[N,N-bis(carboxymethyl)aminomethyl]hydroquinone (H 4cah) and the dinucleating 2,5-bis[N,N-bis(carboxymethy ...
-
Article
Synthetic analogues for oxovanadium(IV) - Glutathione interaction: An EPR, synthetic and structural study of oxovanadium(IV) compounds with sulfhydryl-containing pseudopeptides and dipeptides
(1999)Valuable analogues of the VIVO2+ - glutathione complex have been synthesized and characterized. The reaction of [VIVO(CH3COO)2(phen)] (phen = 1,10-phenanthroline) with the sulfhydryl-containing pseudopeptides (scp) ...
-
Article
Two ligand-binding sites in the O2-sensing signal transducer HemAT: Implications for ligand recognition/discrimination and signaling
(2006)We have identified a ligand (CO) accommodation cavity in the signal transducer sensor protein HemAT (heme-based aerotactic transducer) that allows us to gain single-molecule insights into the mechanism of gas sensor proteins. ...
-
Article
U(VI) mono-hydroxo humate complexation
(2007)The complexation of the uranyl ion with humic acid is investigated. The humic acid ligand concentration is described as the concentration of reactive humic acid molecules based on the number of humic acid molecules, taking ...
-
Article
Vanadium(V) compounds with the bis-(hydroxylamino)-1,3,5-triazine ligand, H2bihyat: Synthetic, structural, and physical studies of [V 2VO3(bihyat)2] and of the enhanced hydrolytic stability species cis-[VVO2(bihyat)] -
(2008)Reaction of the ligand 2,6-bis[hydroxy(methyl)amino]-4-morpholino-1,3,5- triazine (H2bihyat) with NaVVO3 in aqueous solution followed by addition of either Ph4PCl or C(NH 2)3Cl, respectively, gave the mononuclear vanadium(V) ...