通过高通量计算酶-基质相互作用概况,对基质选择性乳酸酶进行特制生物勘探
Ruite Xiang1,2, Helena Balfagon Campos3, Arnau Bassegoda3
1Department of Life Sciences, Barcelona Supercomputing Center (BSC), Barcelona, Spain.
Protein science : a publication of the Protein Society
|February 12, 2026
概括
一个新的计算管道确定了强大的乳糖酶,用于工业用途. 与商业酶相比,两种新的乳酶候选物KAI0175247.1和EPT01171.1显示出优越的催化活性和稳定性.
科学领域:
- 生物技术是生物技术.
- 酶学 是一种酶学.
- 计算生物学 计算生物学
背景情况:
- 乳酶是具有多种生物技术潜力的多铜氧化酶.
- 确定针对特定应用的特定laccases仍然具有挑战性.
研究的目的:
- 开发和验证一条计算管道,用于识别基质特定的乳酸候选物.
- 发现具有增强的催化性能和稳定性的新型乳酸酶.
主要方法:
- 采用了一种结合序列过,蒙特卡洛模拟和量子力学计算的管道.
- 使用甲基注射剂作为模型基质选择了乳糖酶候选物.
- 选择的候选物被表达为Aspergillus oryzae和生化特征.
主要成果:
- 选择了37个laccase序列,其中7个在表达时显示显著活性.
- 两种候选物质KAI0175247.1和EPT01171.1的催化活性 (kcat) 比商用酸盐更高.
- 这些候选物表现出可比或更高的最佳温度和不同的基质特异性.
结论:
- 计算管道对于向的乳糖酶生物勘探是有效的.
- KAI0175247.1和EPT01171.1是可用于工业应用的有希望的生物催化剂.
- 这些发现为开发强大和可持续的酶溶液铺平了道路.
相关概念视频
Enzymes
95.3K
Inside living organisms, enzymes act as catalysts for many biochemical reactions involved in cellular metabolism. The role of enzymes is to reduce the activation energies of biochemical reactions by forming complexes with its substrates. The lowering of activation energies favor an increase in the rates of biochemical reactions.
Enzyme deficiencies can often translate into life-threatening diseases. For example, a genetic abnormality resulting in the deficiency of the enzyme G6PD...
Enzyme deficiencies can often translate into life-threatening diseases. For example, a genetic abnormality resulting in the deficiency of the enzyme G6PD...
95.3K
Enzyme Kinetics
104.4K
Enzymes speed up reactions by lowering the activation energy of the reactants. The speed at which the enzyme turns reactants into products is called the rate of reaction. Several factors impact the rate of reaction, including the number of available reactants. Enzyme kinetics is the study of how an enzyme changes the rate of a reaction.
Scientists typically study enzyme kinetics with a fixed amount of enzyme in the controlled environment of a test tube. When more reactant, or substrate, is...
Scientists typically study enzyme kinetics with a fixed amount of enzyme in the controlled environment of a test tube. When more reactant, or substrate, is...
104.4K
Enzyme-linked Receptors
86.8K
Enzyme-linked receptors are proteins that act as both receptor and enzyme, activating multiple intracellular signals. This is a large group of receptors that include the receptor tyrosine kinase (RTK) family. Many growth factors and hormones bind to and activate the RTKs.
Neurotrophin (NT) receptors are a family of RTKs, including trkA, trkB, and trkC (tropomyosin-related kinase) receptors. TrkA is specific for nerve growth factor (NGF), neurotrophin-6, and neurotrophin-7. TrkB binds...
Neurotrophin (NT) receptors are a family of RTKs, including trkA, trkB, and trkC (tropomyosin-related kinase) receptors. TrkA is specific for nerve growth factor (NGF), neurotrophin-6, and neurotrophin-7. TrkB binds...
86.8K
What is Natural Selection?
129.8K
Natural selection is an evolutionary process in which individuals with survival-promoting traits reproduce at higher rates. These favorable traits become more common within a population or species. Naturally selected traits initially arise via random genetic mutations. In order for selection to occur, there must be variation within a population, the trait controlling the variation must be heritable, and there must be an evolutionary advantage for variation in the trait.
129.8K
Computed Tomography
8.9K
Tomography refers to imaging by sections. Computed tomography (CT) is a non-invasive imaging technique that uses computers to analyze several cross-sectional X-rays to reveal minute details about structures in the body.
The technique was invented in the 1970s and is based on the principle that as X-rays pass through the body, they are absorbed or reflected at different levels. In the technique, a patient lies on a motorized platform while a computerized axial tomography (CAT) scanner rotates...
The technique was invented in the 1970s and is based on the principle that as X-rays pass through the body, they are absorbed or reflected at different levels. In the technique, a patient lies on a motorized platform while a computerized axial tomography (CAT) scanner rotates...
8.9K
Antibiotic Selection
60.2K
Overview
60.2K


