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MolNFT v1 · #105314 · protein

Crystal structure of 3D7 strain plasmodium falciparum AMA1

4R19 · Apical membrane antigen 1, AMA1: “Crystal structure of 3D7 strain plasmodium falciparum AMA1”. X-ray diffraction, 7 pockets (best druggability 0.75). MolNFT v1 #105314 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4R19
Type
protein
Length
638 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Apical membrane antigen 1, AMA1
UniProt
Q7KQK5
Pockets
7 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 17% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AApical membrane antigen 1, AMA1protein32117% helix, 27% strandQ7KQK5
BApical membrane antigen 1, AMA1protein31717% helix, 26% strandQ7KQK5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110890.750.7788empty
22040.580.8024empty
31390.510.7924empty
41100.470.7913empty
5940.420.7815empty

Interfaces

1 interface between chains.

  • A–B · 533 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 9 disulfide (disulfide).

Compared structures

  • 4R19 · Crystal Structure of 3D7 strain Plasmodium falciparum AMA1 · the same entry in another collection · chain A against A, TM-score 1.00

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