19 research outputs found
How Many Protein-Protein Interactions Types Exist in Nature?
“Protein quaternary structure universe” refers to the ensemble of all protein-protein complexes across all organisms in nature. The number of quaternary folds thus corresponds to the number of ways proteins physically interact with other proteins. This study focuses on answering two basic questions: Whether the number of protein-protein interactions is limited and, if yes, how many different quaternary folds exist in nature. By all-to-all sequence and structure comparisons, we grouped the protein complexes in the protein data bank (PDB) into 3,629 families and 1,761 folds. A statistical model was introduced to obtain the quantitative relation between the numbers of quaternary families and quaternary folds in nature. The total number of possible protein-protein interactions was estimated around 4,000, which indicates that the current protein repository contains only 42% of quaternary folds in nature and a full coverage needs approximately a quarter century of experimental effort. The results have important implications to the protein complex structural modeling and the structure genomics of protein-protein interactions
Slab tear and tensional fault systems in the Sunda–Andaman Benioff zone: implications on tectonics and potential seismic hazard
Transverse slab tear faults and longitudinal trench parallel extensional faults present on the top part of Benioff zone in Sunda–Andaman arc between latitude 6°–15°N and longitude 90°–98°E are marked by seismotectonic analysis using contemporary data related to regional tectonics, seismicity, centroid moment tensor (CMT) fault plane solutions, etc. Characteristics of ten numbers of transverse slab tear faults is taken from our previous studies, whereas four numbers of longitudinal trench parallel extensional faults are marked by the present study. These two sets of fault systems make high angle between them and tectonically complement each other. The disposition, origin, tectonic framework, depth of penetration and seismotectonic evaluations of the fault systems are analyzed. An effort is made to identify the potential seismic hazard in the zone between trench and forearc containing Andaman Group of Island
Growth Kinetics of ZnO Nanocrystals in the Presence of a Base: Effect of the Size of the Alkali Cation
Following an earlier study (J. Am. Chem Soc. 2007, 129, 4470) describing a very unusual growth kinetics of ZnO nanoparticles, we critically evaluate here the proposed mechanism involving a crucial role of the alkali base ion in controlling the growth of ZnO nanoparticles using other alkali bases, namely, LiOH and KOH. While confirming the earlier conclusion of the growth of ZnO nanoparticles being hindered by an effective passivating layer of cations present in the reaction mixture and thereby generalizing this phenomenon, present experimental data reveal an intriguing nonmonotonic dependence of the passivation efficacy on the ionic size of the alkali base ion. This unexpected behavior is rationalized on the basis of two opposing factors: (a) solvated cationic radii and (b) dissociation constant of the base
Beyond the ``Coffee Ring'': Re-entrant Ordering in an Evaporation-Driven Self-Assembly in a Colloidal Suspension on a Substrate
We study the phenomenon of evaporation-driven self-assembly of a colloid suspension of silica microspheres in the interior region and away from the rim of the droplet on a glass plate. In view of the importance of achieving a large-area, monolayer assembly, we first realize a suitable choice of experimental conditions, minimizing the influence of many other competing phenomena that usually complicate the understanding of fundamental concepts of such self-assembly processes in the interior region of a drying droplet. Under these simplifying conditions to bring out essential aspects, our experiments unveil an interesting competition between ordering and compaction in such drying systems in analogy to an impending glass transition. We establish a re-entrant behavior in the order disorder phase diagram as a function of the particle density, such that there is an optimal range of the particle density to realize the long-range ordering. The results are explained with the help of simulations and phenomenological theory
Number of estimated complex folds for a range of numbers of complex families.
<p>Number of estimated complex folds for a range of numbers of complex families.</p
The number of new complex structure entries deposited per year in the PDB.
<p>Data are presented in terms of unique structures (sequence identity <90%), families (mapped with unique Pfam families), and folds (rTM-score <0.5).</p
The estimated number of quaternary folds versus the number of quaternary families in nature.
<p>The solid curve is the fitting from Eq. 13 and dotted line indicates the number of quaternary families following Orengo <i>et al</i>. estimation.</p
Histogram of complex structural clusters versus size of the clusters.
<p>The solid curve is the fitting result from Eq. 12. Inset: the same data drawn in logarithm scale.</p
Beyond the “Coffee Ring”: Re-entrant Ordering in an Evaporation-Driven Self-Assembly in a Colloidal Suspension on a Substrate
We study the phenomenon of evaporation-driven
self-assembly of
a colloid suspension of silica microspheres in the interior region
and away from the rim of the droplet on a glass plate. In view of
the importance of achieving a large-area, monolayer assembly, we first
realize a suitable choice of experimental conditions, minimizing the
influence of many other competing phenomena that usually complicate
the understanding of fundamental concepts of such self-assembly processes
in the interior region of a drying droplet. Under these simplifying
conditions to bring out essential aspects, our experiments unveil
an interesting competition between ordering and compaction in such
drying systems in analogy to an impending glass transition. We establish
a re-entrant behavior in the order–disorder phase diagram as
a function of the particle density, such that there is an optimal
range of the particle density to realize the long-range ordering.
The results are explained with the help of simulations and phenomenological
theory
Microscopic description of the evolution of the local structure and an evaluation of the chemical pressure concept in a solid solution
Extended x-ray absorption fine-structure studies have been performed at the Zn K and Cd K edges for a series of solid solutions of wurtzite Zn1-xCdxS samples with x = 0.0, 0.1, 0.25, 0.5, 0.75, and 1.0, where the lattice parameter as a function of x evolves according to the well-known Vegard's law. In conjunction with extensive, large-scale first-principles electronic structure calculations with full geometry optimizations, these results establish that the percentage variation in the nearest-neighbor bond distances are lower by nearly an order of magnitude compared to what would be expected on the basis of lattice parameter variation, seriously undermining the chemical pressure concept. With experimental results that allow us to probe up to the third coordination shell distances, we provide a direct description of how the local structure, apparently inconsistent with the global structure, evolves very rapidly with interatomic distances to become consistent with it. We show that the basic features of this structural evolution with the composition can be visualized with nearly invariant Zn-S-4 and Cd-S-4 tetrahedral units retaining their structural integrity, while the tilts between these tetrahedral building blocks change with composition to conform to the changing lattice parameters according to the Vegard's law within a relatively short length scale. These results underline the limits of applicability of the chemical pressure concept that has been a favored tool of experimentalists to control physical properties of a large variety of condensed matter systems