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Crystal structure of vascular endothelial growth factor-B in complex with a neutralizing antibody Fab fragment

Analyse Crystal structure of vascular endothelial growth factor-B in complex with a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2VWE
Type
protein
Length
1,060 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vascular endothelial growth factor B; Anti-VEGF-B monoclonal antibody
UniProt
P49765
Pockets
14 · best druggability 0.63

Structure

x-ray diffraction · 3 distinct chains · 5% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BVascular endothelial growth factor Bprotein978% helix, 56% strandP49765
C, JAnti-VEGF-B monoclonal antibodyprotein2145% helix, 47% strand—
E, LAnti-VEGF-B monoclonal antibodyprotein2193% helix, 47% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16050.630.7486empty
23040.550.7640empty
31980.460.7433empty
41210.410.7621empty
5500.370.8017empty

Interfaces

11 interfaces between chains.

  • C–E · 2061 Ų buried · 24 hydrogen bonds · protein-protein
  • J–L · 2025 Ų buried · 25 hydrogen bonds · protein-protein
  • A–B · 1488 Ų buried · 14 hydrogen bonds · protein-protein
  • B–L · 690 Ų buried · 5 hydrogen bonds · protein-protein
  • A–E · 666 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 disulfide (disulfide).

Compared structures

  • 2VWE · Crystal Structure of Vascular Endothelial Growth Factor-B in Complex with a Neutralizing… · the same entry in another collection · chain C against C, TM-score 1.00
  • P49765 · AlphaFold monomer V2.0 prediction for vascular endothelial growth factor B (P49765) · a predicted model of the same protein · chain A against A, TM-score 0.92

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