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The structure of the plasmodium falciparum 20S proteasome in complex with one PA28 activator

Analyse The structure of the plasmodium falciparum 20S proteasome in complex with one… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6MUX
Type
protein
Length
7,501 residues
Chains
35
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
20S proteasome alpha-1 subunit; 20S proteasome alpha-2 subunit; 20S proteasome alpha-3…
EC
3.4.25.1
UniProt
Q8IAR3, C6KST3, Q8IDG3, Q8IDG2, Q8IBI3, Q8IK90, O77396, Q8I0U7, Q8I6T3, Q8I261, Q8IKC9, Q8IJT1, C0H4E8, Q7K6A9, Q8I374
Pockets
20 · best druggability 0.80

Structure

electron microscopy · 22 distinct chains · 36% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, O20S proteasome alpha-1 subunit (EC 3.4.25.1)protein24435% helix, 17% strandQ8IAR3
B20S proteasome alpha-2 subunit (EC 3.4.25.1)protein22432% helix, 18% strandC6KST3
C20S proteasome alpha-3 subunit (EC 3.4.25.1)protein24034% helix, 16% strandQ8IDG3
D20S proteasome alpha-4 subunit (EC 3.4.25.1)protein22732% helix, 19% strandQ8IDG2
E20S proteasome alpha-5 subunit (EC 3.4.25.1)protein22728% helix, 17% strandQ8IBI3
F20S proteasome alpha-6 subunit (EC 3.4.25.1)protein23526% helix, 18% strandQ8IK90
G, U20S proteasome alpha-7 subunit (EC 3.4.25.1)protein23327% helix, 17% strandO77396
H, V20S proteasome beta-1 subunit (EC 3.4.25.1)protein19423% helix, 23% strandQ8I0U7
I, W20S proteasome beta-2 subunit (EC 3.4.25.1)protein21926% helix, 22% strandQ8I6T3
J, X20S proteasome beta-3 subunit (EC 3.4.25.1)protein20328% helix, 22% strandQ8I261
K, Y20S proteasome beta-4 subunit (EC 3.4.25.1)protein19531% helix, 25% strandQ8IKC9
L, Z20S proteasome beta-5 subunit (EC 3.4.25.1)protein20429% helix, 13% strandQ8IJT1
M, a20S proteasome beta-6 subunit (EC 3.4.25.1)protein21126% helix, 27% strandC0H4E8
N, b20S proteasome beta-7 subunit (EC 3.4.25.1)protein22430% helix, 22% strandQ7K6A9
P20S proteasome alpha-2 subunit (EC 3.4.25.1)protein22934% helix, 19% strandC6KST3
Q20S proteasome alpha-3 subunit (EC 3.4.25.1)protein24531% helix, 17% strandQ8IDG3
R20S proteasome alpha-4 subunit (EC 3.4.25.1)protein23327% helix, 24% strandQ8IDG2
S20S proteasome alpha-5 subunit (EC 3.4.25.1)protein22830% helix, 19% strandQ8IBI3
T20S proteasome alpha-6 subunit (EC 3.4.25.1)protein23433% helix, 18% strandQ8IK90
cProteasome activator PA28protein18880% helix, 0% strandQ8I374
d, f, g, h, iProteasome activator PA28protein19079% helix, 0% strandQ8I374
eProteasome activator PA28protein18780% helix, 0% strandQ8I374

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111480.800.81119empty
211980.780.80143empty
38280.780.8194empty
46900.770.8270empty
56900.770.8280empty

Interfaces

100 interfaces between chains.

  • e–f · 2177 Ų buried · 15 hydrogen bonds · protein-protein
  • c–i · 2094 Ų buried · 12 hydrogen bonds · protein-protein
  • f–g · 2073 Ų buried · 15 hydrogen bonds · protein-protein
  • h–i · 2067 Ų buried · 13 hydrogen bonds · protein-protein
  • g–h · 2066 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6MUX · The structure of the Plasmodium falciparum 20S proteasome in complex with one PA28… · the same entry in another collection · chain B against B, TM-score 1.00

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