GL1X · GenesisL1 explorer

Research workbench

The structure of monodechloro-teicoplanin in complex with its ligand, using ubiquitin as a ligand carrier

Analyse The structure of monodechloro-teicoplanin in complex with its ligand, using… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3VFK
Type
protein
Length
86 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.8
Source
Actinoplanes teichomyceticus; Homo sapiens
Molecule
ubiquitin, C-terminal fused by Cys-Lys-D-Ala-D-Ala; MonodeChloro- Teicoplanin A2-2
UniProt
P0CG48
Ligands
T55, GCS, NAG, MAN

Structure

x-ray diffraction · resolution 2.8 · 2 distinct chains · 20% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
Aubiquitin, C-terminal fused by Cys-Lys-D-Ala-D-Alaprotein7922% helix, 34% strandP0CG48
GMonodeChloro- Teicoplanin A2-2protein70% helix, 14% strand—

Ligands and binding sites

  • T55 · 8-methylnonanoic acid · ligand · chains G
  • GCS · 2-amino-2-deoxy-beta-D-glucopyranose · sugar · chains A, G
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A, G
  • MAN · alpha-D-mannopyranose · sugar · chains A, G

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Interfaces

1 interface between chains.

  • A–G · 296 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified, 3 glycan, 2 d-amino (nonstandard, glycosylation, D-amino acid).

Compared structures

  • 3VFK · The structure of monodechloro-teicoplanin in complex with its ligand, using ubiquitin as… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0CG48 · AlphaFold monomer V2.0 prediction for polyubiquitin-C (P0CG48) · a predicted model of the same protein · chain A against A, TM-score 0.88

Analyse

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.