Results 181 to 190 of about 424,634 (266)

Relative Interacting Atomic Energy Analysis of the Anomeric Effect in Cyclic and Acyclic O-C-X Systems. [PDF]

Molecules
Domingo LR, Ríos-Gutiérrez M, Pérez P.   +2 more
europepmc   +1 more source

Structural and biochemical insights into the thermostable esterase Ta0887 from Thermoplasma acidophilum

FEBS Open Bio, EarlyView.
In this study, a novel esterase from the thermoacidophilic archaeon Thermoplasma acidophilum was biochemically and structurally characterized. Our results demonstrate that Ta0887 is a highly thermostable esterase that preferentially hydrolyzes p‐nitrophenyl hexanoate and possesses an α‐helical cap domain that likely contributes to its substrate ...
Alejandro Delgado‐Rey, Miriam Livier Llamas‐García, Gabriela M. Montero‐Morán, Leticia Santos, Samuel Lara‐González   +4 more
wiley   +1 more source

A synthetic pseudopotential benchmark for testing production pseudopotentials and constructing pseudopotentials with chemical accuracy.

Phys Chem Chem Phys
Gulans A, Brakestad A, Jensen SR, Gubler M, Frediani L, Goedecker S.   +5 more
europepmc   +1 more source

A Unified Hierarchical Multiscale Fusion Framework for Drug-Target Affinity Prediction: From Benchmark Performance to Nanomolar Inhibitor Discovery. [PDF]

Adv Sci (Weinh)
Liu S, Zhang X, Feng H, Li Y, Gong X, Liang Y, Yao X, Liu H.   +7 more
europepmc   +1 more source

Threonine 348 regulates the subcellular localization of PTEN

FEBS Open Bio, EarlyView.
Thr348 in the C2 domain is a key contributor to PTEN subcellular localization. The PTEN350 fragment and PTENA4 accumulated in the nucleus, whereas PTENK13R,A4 predominantly localized to the plasma membrane. In contrast, substitution of Thr348 with Asp (T348D) disrupted these characteristic localization patterns, resulting in predominant cytoplasmic ...
Takashi Kato, Suzu Tanaka, Miyu Ohashi
wiley   +1 more source

Twist degree of freedom activated by pressure-driven interlayer engineering in spiral WS₂. [PDF]

Nat Commun
Ci P, Sun M, Chen Y, Rho Y, Zhao Y, Xin K, Mai Z, Liang S, Wang Z, Wu J, Hong H, Wei Z, Grigoropoulos CP, Liu YY, Tan PH, Wu J.   +15 more
europepmc   +1 more source

Salmonella enterica serovar typhi limits the potency of typhoid toxin and ADP‐ribosylating toxin AB to establish a persistent infection

FEBS Open Bio, EarlyView.
The two catalytic subunits of typhoid toxin dissociate from the holotoxin in the ER of an intoxicated cell, but only CdtB exits the ER to generate immunosuppressive effects. PltA is retained in the ER and sequestered from its cytosolic target, thus allowing the anti‐inflammatory effects of CdtB to promote intestinal colonization.
Maria C. Zabala‐Rodriguez, Juliette K. Tinker, Teresa Frisan, Taj Azarian, Ken Teter   +4 more
wiley   +1 more source

DL_FFLUX Refactored: Accelerating Quantum Chemical Topology Simulations With Optimized Parallelization. [PDF]

J Comput Chem
Nosratjoo M, Bane MK, Popelier PLA.
europepmc   +1 more source

The C‐terminal truncated splicing variant of NK1R negatively modulates substance P‐stimulated NK1R signaling

FEBS Open Bio, EarlyView.
The neurokinin 1 receptor exists as full‐length (NK1L) and C‐terminally truncated (NK1S) splice variants. We show that NK1S heterodimerizes with NK1L, impairing Gαq coupling and Ca2+ mobilization while enhancing β‐arrestin1 recruitment. NK1S suppresses substance P‐driven gene expression and cell migration, revealing NK1S as an endogenous biased ...
Lan Phuong Nguyen, Duc Trung Nguyen, Minyoung Cho, Jihun Kim, Soyeon In, Thai Uy Nguyen, Sunghoon Hurh, Beom Jin Park, Jong‐Ik Hwang   +8 more
wiley   +1 more source

Interaction topology theory deciphers multiscale codes of MOF-like materials. [PDF]

Sci Adv
Chen D, Liu J, Chen CL, Wei GW.
europepmc   +1 more source