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MolNFT v1 · #123566 · protein

Structure of proplasmepsin IV from plasmodium falciparum

5JOD: “Structure of proplasmepsin IV from plasmodium falciparum”. X-ray diffraction, 5 pockets (best druggability 0.75). MolNFT v1 #123566 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5JOD
Type
protein
Length
750 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Proplasmepsin IV
UniProt
W7FF86
Pockets
5 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 18% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BProplasmepsin IVprotein37518% helix, 41% strandW7FF86

Ligands and binding sites

  • GOL · Glycerol · additive · 9 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16480.750.8177empty
25610.740.8261GOL
34380.650.7848GOL
41310.410.7526empty
5870.400.7819empty

Interfaces

1 interface between chains.

  • A–B · 610 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide, 1 covalent (disulfide, additive adduct).

Compared structures

  • 5JOD · Structure of proplasmepsin IV from Plasmodium falciparum · the same entry in another collection · chain A against A, TM-score 1.00

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