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Crystal structure of a chimeric antigen receptor (car) scfv domain rearrangement forming a vl-vl dimer

Analyse Crystal structure of a chimeric antigen receptor (car) scfv domain… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7JO8
Type
protein
Length
217 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
47G4-CD828Z
Pockets
3 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 6% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A47G4-CD828Zprotein1076% helix, 50% strand—
B47G4-CD828Zprotein1105% helix, 48% strand—

Ligands and binding sites

  • 1PE · Pentaethylene glycol · additive · chains A, B
  • MLI · Malonate ion · additive · chains A, B
  • PG4 · Tetraethylene glycol · additive · chains A, B

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11000.390.7617empty
2770.390.78201PE
3820.380.7719PG4

Interfaces

1 interface between chains.

  • A–B · 739 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7JO8 · Crystal structure of a Chimeric Antigen Receptor (CAR) scFv domain rearrangement forming… · the same entry in another collection · chain A against A, TM-score 1.00

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