Back

Amino acid characteristics in protein native state structures

Skrbic, T.; Giacometti, A.; Hoang, T. X.; Maritan, A.; Banavar, J. R.

2023-12-13 biophysics
10.1101/2023.12.12.571261 bioRxiv
Show abstract

We present a geometrical analysis of the protrusion statistics of side chains in more than 4,000 high-resolution protein structures. We employ a coarse-grained representation of the protein backbone viewed as a linear chain of C atoms and consider just the heavy atoms of the side chains. We study the large variety of behaviors of the amino acids based on both rudimentary structural chemistry as well as geometry. Our geometrical analysis uses a backbone Frenet coordinate system for the common study of all amino acids. Our analysis underscores the richness of the repertoire of amino acids that is available to nature to design protein sequences that fit within the putative native state folds.

Matching journals

The top 5 journals account for 50% of the predicted probability mass.

1
Proteins: Structure, Function, and Bioinformatics
88 papers in training set
Top 0.1%
22.5%
2
The Journal of Physical Chemistry B
167 papers in training set
Top 0.2%
7.9%
3
Biophysical Journal
631 papers in training set
Top 1.0%
7.9%
4
Journal of Chemical Information and Modeling
238 papers in training set
Top 0.6%
7.9%
5
PLOS Computational Biology
1863 papers in training set
Top 5%
6.8%
50% of probability mass above
6
PLOS ONE
5266 papers in training set
Top 30%
5.2%
7
Frontiers in Molecular Biosciences
102 papers in training set
Top 0.2%
3.3%
8
Scientific Reports
3612 papers in training set
Top 40%
2.7%
9
Biomolecules
100 papers in training set
Top 0.7%
2.1%
10
Molecules
39 papers in training set
Top 0.6%
1.7%
11
International Journal of Molecular Sciences
494 papers in training set
Top 7%
1.7%
12
Journal of Chemical Theory and Computation
140 papers in training set
Top 0.7%
1.7%
13
Journal of Molecular Biology
232 papers in training set
Top 2%
1.7%
14
Physical Review E
112 papers in training set
Top 0.8%
1.7%
15
Journal of Structural Biology
64 papers in training set
Top 0.5%
1.4%
16
Physical Biology
46 papers in training set
Top 0.5%
1.3%
17
The Journal of Physical Chemistry Letters
63 papers in training set
Top 0.6%
1.1%
18
Protein Science
246 papers in training set
Top 3%
1.1%
19
Journal of Computational Chemistry
13 papers in training set
Top 0.2%
1.1%
20
Entropy
21 papers in training set
Top 0.2%
1.0%
21
Physica A: Statistical Mechanics and its Applications
13 papers in training set
Top 0.2%
1.0%
22
Biochimica et Biophysica Acta (BBA) - Biomembranes
36 papers in training set
Top 0.3%
1.0%
23
Biophysical Chemistry
15 papers in training set
Top 0.2%
1.0%
24
Computational and Structural Biotechnology Journal
242 papers in training set
Top 8%
0.6%
25
Communications Biology
993 papers in training set
Top 34%
0.6%
26
Journal of Molecular Graphics and Modelling
17 papers in training set
Top 0.4%
0.6%
27
Journal of The Royal Society Interface
235 papers in training set
Top 5%
0.6%