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Anti-phosphotyrosine antibody PY20-4D5 Fab complexed with sulfate

Analyse Anti-phosphotyrosine antibody PY20-4D5 Fab complexed with sulfate in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6DEZ
Type
protein
Length
836 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Anti-phosphotyrosine antibody PY20-4D5 light chain; Anti-phosphotyrosine antibody…
Ligands
SO4
Pockets
11 · best druggability 0.63

Structure

x-ray diffraction · 4 distinct chains · 6% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LAnti-phosphotyrosine antibody PY20-4D5 light chainprotein2065% helix, 47% strand—
HAnti-phosphotyrosine antibody PY20-4D5 heavy chainprotein2178% helix, 49% strand—
AAnti-phosphotyrosine antibody PY20-4D5 light chainprotein2035% helix, 45% strand—
BAnti-phosphotyrosine antibody PY20-4D5 heavy chainprotein2106% helix, 44% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains H, A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17020.630.7360empty
25120.590.7465empty
31590.500.7833empty
42130.460.7425empty
51790.440.7528empty

Interfaces

3 interfaces between chains.

  • L–H · 1663 Ų buried · 15 hydrogen bonds · protein-protein
  • A–B · 1440 Ų buried · 13 hydrogen bonds · protein-protein
  • L–A · 705 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 6DEZ · Anti-phosphotyrosine antibody PY20-4D5 Fab complexed with sulfate · the same entry in another collection · chain L against L, TM-score 1.00

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