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Structure of legionella pneumophila dotn

Analyse Structure of legionella pneumophila dotn in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5X1H
Type
protein
Length
2,351 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Icmj (dotn)
UniProt
Q5ZYB7
Ligands
ZN
Pockets
20 · best druggability 0.74

Structure

x-ray diffraction · 5 distinct chains · 48% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AIcmj (dotn)protein19946% helix, 10% strandQ5ZYB7
C, WIcmj (dotn)protein19648% helix, 12% strandQ5ZYB7
E, G, IIcmj (dotn)protein19747% helix, 11% strandQ5ZYB7
KIcmj (dotn)protein19448% helix, 11% strandQ5ZYB7
M, O, Q, S, UIcmj (dotn)protein19552% helix, 11% strandQ5ZYB7

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains A, C, E, G, I, K, M, O, Q, S, U, W

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 15 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16670.740.8071empty
26260.720.7956empty
36430.700.7878empty
45890.670.7749empty
52840.630.8040empty

Interfaces

16 interfaces between chains.

  • A–C · 1269 Ų buried · 9 hydrogen bonds · protein-protein
  • E–W · 1060 Ų buried · 3 hydrogen bonds · protein-protein
  • K–M · 1058 Ų buried · 9 hydrogen bonds · protein-protein
  • G–Q · 1054 Ų buried · 5 hydrogen bonds · protein-protein
  • I–U · 1039 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5X1H · Structure of Legionella pneumophila DotN · the same entry in another collection · chain A against A, TM-score 1.00

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