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Structural basis for the binding of monoclonal antibody 5D2 to the tryptophan-rich lipid-binding loop in lipoprotein lipase

Analyse Structural basis for the binding of monoclonal antibody 5D2 to the… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6WN4
Type
protein
Length
877 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5D2 Fab heavy chain; 5D2 Fab light chain; Lipoprotein lipase peptide
UniProt
P06858
Pockets
7 · best druggability 0.78

Structure

x-ray diffraction · 5 distinct chains · 7% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5D2 Fab heavy chainprotein2147% helix, 52% strand—
B5D2 Fab light chainprotein2086% helix, 52% strand—
C, DLipoprotein lipase peptideprotein1145% helix, 0% strandP06858
H5D2 Fab heavy chainprotein2217% helix, 51% strand—
L5D2 Fab light chainprotein2126% helix, 51% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19210.780.8197empty
26680.640.7480empty
31540.530.8019empty
4580.380.8017empty
5810.330.7419empty

Interfaces

9 interfaces between chains.

  • H–L · 1886 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 1806 Ų buried · 12 hydrogen bonds · protein-protein
  • A–C · 495 Ų buried · 16 hydrogen bonds · protein-protein
  • D–H · 488 Ų buried · 11 hydrogen bonds · protein-protein
  • A–L · 401 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 6WN4 · Structural basis for the binding of monoclonal antibody 5D2 to the tryptophan-rich… · the same entry in another collection · chain C against C, TM-score 1.00
  • P06858 · AlphaFold monomer V2.0 prediction for lipoprotein lipase (P06858) · a predicted model of the same protein · chain C against A, TM-score 0.55

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