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X-ray structure of the Fab fragment of the anti tau antibody RB86 in complex with the phosphorylated tau peptide (416-430)

Analyse X-ray structure of the Fab fragment of the anti tau antibody RB86 in complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5DMG
Type
protein
Length
1,278 residues
Chains
9
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RB86 antibody Fab fragment heavy chain; RB86 antibody Fab fragment light chain…
UniProt
B4DSE3
Pockets
11 · best druggability 0.77

Structure

x-ray diffraction · 8 distinct chains · 5% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
H, CRB86 antibody Fab fragment heavy chainprotein2026% helix, 51% strand—
LRB86 antibody Fab fragment light chainprotein2166% helix, 52% strand—
DRB86 antibody Fab fragment light chainprotein2176% helix, 51% strand—
ERB86 antibody Fab fragment heavy chainprotein1983% helix, 54% strand—
FRB86 antibody Fab fragment light chainprotein2155% helix, 47% strand—
ZMicrotubule-associated proteinprotein90% helix, 0% strandB4DSE3
PMicrotubule-associated proteinprotein120% helix, 0% strandB4DSE3
XMicrotubule-associated proteinprotein70% helix, 0% strandB4DSE3

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17120.770.8279empty
25430.610.7465empty
33980.590.7645empty
41510.550.8137empty
5570.460.8521empty

Interfaces

15 interfaces between chains.

  • C–D · 1601 Ų buried · 12 hydrogen bonds · protein-protein
  • E–F · 1579 Ų buried · 13 hydrogen bonds · protein-protein
  • H–L · 1572 Ų buried · 17 hydrogen bonds · protein-protein
  • H–P · 469 Ų buried · 7 hydrogen bonds · protein-protein
  • D–Z · 391 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 disulfide, 3 modified (disulfide, phosphorylation).

Compared structures

  • 5DMG · X-ray structure of the Fab fragment of the anti tau antibody RB86 in complex with the… · the same entry in another collection · chain H against H, TM-score 1.00

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