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Merozoite surface protein 1 (msp-1) from plasmodium falciparum, alternative conformation 2

Analyse Merozoite surface protein 1 (msp-1) from plasmodium falciparum, alternative… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ZBD
Type
protein
Length
1,159 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Merozoite surface antigens; Merozoite surface protein-1; Merozoite surface protein 1
UniProt
Q25922, M1V901, M1VNZ6, C4PDY5
Pockets
20 · best druggability 0.75

Structure

electron microscopy · 4 distinct chains · 79% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMerozoite surface antigensprotein56178% helix, 1% strandQ25922
BMerozoite surface antigensprotein11274% helix, 1% strandM1V901
CMerozoite surface protein-1protein28578% helix, 1% strandM1VNZ6
DMerozoite surface protein 1protein20186% helix, 1% strandC4PDY5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111450.750.78111empty
2560.670.9515empty
35990.670.7655empty
43330.600.7728empty
52630.600.7926empty

Interfaces

5 interfaces between chains.

  • B–C · 3002 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 2321 Ų buried · 12 hydrogen bonds · protein-protein
  • C–D · 2193 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 1507 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 983 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6ZBD · Merozoite surface protein 1 (MSP-1) from Plasmodium falciparum, alternative conformation 2 · the same entry in another collection · chain A against A, TM-score 1.00

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