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Crystal structure of fvo strain plasmodium falciparum AMA1 in complex with the RON2HP [THR2040ALA] peptide

Analyse Crystal structure of fvo strain plasmodium falciparum AMA1 in complex with the… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4Z09
Type
protein
Length
283 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Apical membrane antigen 1; Rhoptry neck protein 2
UniProt
A0A024UZE1
Pockets
1 · best druggability 0.27

Structure

x-ray diffraction · 2 distinct chains · 15% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AApical membrane antigen 1protein27016% helix, 31% strandA0A024UZE1
CRhoptry neck protein 2protein130% helix, 38% strand—

Ligands and binding sites

  • GOL · Glycerol · additive · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1610.270.7214empty

Interfaces

1 interface between chains.

  • A–C · 609 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 5 disulfide (disulfide).

Compared structures

  • 4Z09 · Crystal structure of FVO strain Plasmodium falciparum AMA1 in complex with the RON2hp… · the same entry in another collection · chain A against A, TM-score 1.00

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