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Murine T-cell antigen receptor 2C clone

Analyse Murine T-cell antigen receptor 2C clone in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1TCR
Type
protein
Length
439 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Alpha, beta T-cell receptor (VB8.2DB2JB2.4CB2\
Ligands
NAG, FUC, BMA, SO4
Pockets
4 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAlpha, beta T-cell receptor (VB8.2DB2JB2.4CB2\protein2023% helix, 44% strand—
BAlpha, beta T-cell receptor (VB8.2DB2JB2.4CB2\protein2377% helix, 51% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 7 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · 2 copies · chains B
  • BMA · beta-D-mannopyranose · sugar
  • SO4 · Sulfate ion · ion · 3 copies · chains B, A

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110600.730.7682empty
22100.510.7744empty
31140.440.7824empty
4890.400.7820empty

Interfaces

1 interface between chains.

  • A–B · 2221 Ų buried · 24 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 glycan, 3 disulfide (N-glycosylation, disulfide).

Compared structures

  • 1TCR · Murine T-cell antigen receptor 2C clone · the same entry in another collection · chain A against A, TM-score 1.00

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