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MolNFT v1 · #125970 · protein

Helical assembly of the anbu complex from pseudomonas aeruginosa

5LOX · Peptidase: “Helical assembly of the anbu complex from pseudomonas aeruginosa”. X-ray diffraction, 20 pockets (best druggability 0.78). MolNFT v1 #125970 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5LOX
Type
protein
Length
8,194 residues
Chains
34
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peptidase
UniProt
A0A0D6I0H1
Pockets
20 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P, Q, R, S, T, U, V, W, X, Y, Z, 1, 2, 3, 4, 5, 6, 7, 8Peptidaseprotein24134% helix, 28% strandA0A0D6I0H1

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1980.780.9820empty
2940.780.9820empty
3920.780.9920empty
4970.780.9820empty
58000.780.8195empty

Interfaces

74 interfaces between chains.

  • U–V · 2323 Ų buried · 23 hydrogen bonds · protein-protein
  • K–L · 2305 Ų buried · 23 hydrogen bonds · protein-protein
  • 5–6 · 2301 Ų buried · 22 hydrogen bonds · protein-protein
  • W–X · 2292 Ų buried · 21 hydrogen bonds · protein-protein
  • E–F · 2289 Ų buried · 22 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 170 modified (engineered).

Compared structures

  • 5LOX · Helical Assembly of the Anbu Complex from Pseudomonas aeruginosa · the same entry in another collection · chain B against B, TM-score 1.00

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