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MolNFT v1 · #171628 · protein

Merozoite surface protein 1 (msp-1) from plasmodium falciparum, alternative conformation 4

6ZBG · Merozoite surface antigens: “Merozoite surface protein 1 (msp-1) from plasmodium falciparum, alternative conformation 4”. Electron microscopy, 19 pockets (best druggability 0.76). MolNFT v1 #171628 on GenesisL1: 3D structure…

PDB
6ZBG
Type
protein
Length
1,160 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
19 · best druggability 0.76

Structure

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

ChainMoleculeTypeResiduesSecondary structureUniProt
AMerozoite surface antigensprotein56278% helix, 1% strandQ25922
BMerozoite surface antigensprotein11276% helix, 1% strandM1V901
CMerozoite surface protein-1protein28577% helix, 1% strandM1VNZ6
DMerozoite surface protein 1protein20186% helix, 1% strandC4PDY5

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110290.760.7893empty
21460.640.8631empty
34420.630.7740empty
43860.620.7748empty
53390.610.7831empty

Interfaces

5 interfaces between chains.

  • B–C · 3006 Ų buried · 19 hydrogen bonds · protein-protein
  • A–B · 2297 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 2235 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 1488 Ų buried · 7 hydrogen bonds · protein-protein
  • A–D · 998 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6ZBG · Merozoite surface protein 1 (MSP-1) from Plasmodium falciparum, alternative conformation 4 · the same entry in another collection · chain A against A, TM-score 1.00

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