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Crystal structure of methylated PVS25, an ookinete protein from plasmodium vivax

Analyse Crystal structure of methylated PVS25, an ookinete protein from plasmodium vivax in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1Z1Y
Type
protein
Length
352 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ookinete surface protein PVS25
UniProt
O96555
Ligands
YB
Pockets
6 · best druggability 0.65

Structure

x-ray diffraction · 2 distinct chains · 3% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOokinete surface protein PVS25protein1773% helix, 49% strandO96555
BOokinete surface protein PVS25protein1753% helix, 47% strandO96555

Ligands and binding sites

  • YB · Ytterbium (III) ion · metal · 9 copies · chains A, B

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

Pockets

6 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12720.650.8137YB
23260.610.7836empty
32950.590.7833empty
43690.560.7436empty
51710.510.7830empty

Interfaces

1 interface between chains.

  • A–B · 625 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 36 modified, 22 disulfide (methylation, disulfide).

Compared structures

  • 1Z1Y · Crystal structure of Methylated Pvs25, an ookinete protein from Plasmodium vivax · the same entry in another collection · chain A against A, TM-score 1.00

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