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Plasmodium vivax reticulocyte binding protein 2B (PVRBP2B) bound to monoclonal antibody 6H1

Analyse Plasmodium vivax reticulocyte binding protein 2B (PVRBP2B) bound to monoclonal… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6BPE
Type
protein
Length
2,194 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Reticulocyte binding protein 2, putative; Monoclonal antibody 6H1 Fab heavy chain…
UniProt
A5K736
Pockets
20 · best druggability 0.80

Structure

x-ray diffraction · 10 distinct chains · 43% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AReticulocyte binding protein 2, putativeprotein29979% helix, 3% strandA5K736
BMonoclonal antibody 6H1 Fab heavy chainprotein2095% helix, 48% strand—
CMonoclonal antibody 6H1 Fab light chainprotein1996% helix, 44% strand—
DReticulocyte binding protein 2, putativeprotein30276% helix, 3% strandA5K736
EMonoclonal antibody 6H1 Fab heavy chainprotein2085% helix, 42% strand—
FMonoclonal antibody 6H1 Fab light chainprotein1986% helix, 50% strand—
GReticulocyte binding protein 2, putativeprotein30276% helix, 3% strandA5K736
HMonoclonal antibody 6H1 Fab heavy chainprotein1130% helix, 42% strand—
IMonoclonal antibody 6H1 Fab light chainprotein670% helix, 15% strand—
JReticulocyte binding protein 2, putativeprotein29771% helix, 3% strandA5K736

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12690.800.9242empty
28980.780.8089empty
34400.780.8652empty
48090.680.7553empty
56090.670.7742empty

Interfaces

15 interfaces between chains.

  • E–F · 1842 Ų buried · 16 hydrogen bonds · protein-protein
  • B–C · 1731 Ų buried · 10 hydrogen bonds · protein-protein
  • A–J · 1119 Ų buried · 3 hydrogen bonds · protein-protein
  • H–I · 744 Ų buried · 4 hydrogen bonds · protein-protein
  • G–J · 666 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 18 disulfide (disulfide).

Compared structures

  • 6BPE · Plasmodium vivax reticulocyte binding protein 2b (PvRBP2b) bound to monoclonal antibody… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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