Protein
Classification
And Structure
prediction
Ramachandran plot
Turns and Loops
Tertiary structure
Motifs:
-Also called supersecondary structures or folds
-Stable arrangements of several elements of secondary structure
and connections between them
Domains:
Polypeptides with more than a few hundred amino acid residues
often fold into two or more stable, globular units
Stable folding patterns in proteins
Stable folding patterns in proteins
Stable folding patterns in proteins
Stable folding patterns in proteins
Quaternary structure
The spatial arrangement of different subunits
Forces involved are,
1. Vander Waals
2. London Dispersions
3. Salt bridges
4. H-bonds
Protein structure classification
1. Alpha or α/α
2. Beta or β /β
3. Alpha/Beta or α/β
4. Alpha and Beta or α+β
Steric properties of amino acids can greatly affect the local
structures that a protein adopts
Structural configuration Amino acid
Propensity for alpha-helix Ala, Leu, Glu
Disrupt alpha-helix Ser, Asp, Asn
Propensity for Beta-sheets and
disrupt alpha-helix Val and Ile
Propensity for turns Gly, Pro, Asp
Protein structure Databases
Protein Data Bank
Large global repository for the processing and distribution of
3-D macromolecular structure data (experimental)
MMDB (Molecular modelling Database)
Macromolecular 3D structures as well as tools for their
visualization and comparative analysis
Protein structure Visualization
Databases and tools
Cn3-D
Structure and sequence alignment viewer for NCBI databases
RasMol
One of the most popular tools for protein structure visualization
Swiss-PDB Viewer
An interface to analyze several proteins at the same time
It is tightly linked to Swiss-model, an automated homology
modelling server
Protein structure Visualization
Databases and tools
Kinemage
An illustration presented as an interactive computer display
PDBsum
Pictorial summary of the key information on each
macromolecular structure from PDB
Protein structure alignment
VAST (Vector alignment Search Tool)
Developed at NCBI
Used to identify similar protein 3D structures in MMDB/PDB
DALI Server
An automated protein structure alignment tool
Domain Architecture Databases
CDD (Conserved Domain Database)
NCBI database
Collection of sequence alignments and profiles, representing
protein

Protein structure classification