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The Crystal Structure of a Pathogenic Protein from the Xanthomonas campestris Reveals a New Tetrameric PilZ Domain Self-Assembled via a Unusual Helical Bundle

Analyse The Crystal Structure of a Pathogenic Protein from the Xanthomonas campestris… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3PH1
Type
protein
Length
715 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.1
Source
Xanthomonas campestris pv. campestris
Molecule
Putative uncharacterized protein
UniProt
B0RT03
Pockets
7 · best druggability 0.80

Structure

x-ray diffraction · resolution 2.1 · 4 distinct chains · 37% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative uncharacterized proteinprotein18037% helix, 26% strandB0RT03
BPutative uncharacterized proteinprotein16836% helix, 29% strandB0RT03
CPutative uncharacterized proteinprotein18538% helix, 25% strandB0RT03
DPutative uncharacterized proteinprotein18237% helix, 27% strandB0RT03

Ligands and binding sites

  • ACT · Acetate ion · additive · 4 copies · chains A, D, B, C

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

Pockets

7 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18230.800.8381ACT
27700.780.8277ACT
36740.760.8265ACT
44450.680.8059ACT
51220.570.8222empty

Interfaces

6 interfaces between chains.

  • A–D · 1269 Ų buried · 14 hydrogen bonds · protein-protein
  • C–D · 1188 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 1155 Ų buried · 15 hydrogen bonds · protein-protein
  • B–C · 1017 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 78 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3PH1 · The crystal structure of a pathogenic protein from the xanthomonas campestris reveals a… · the same entry in another collection · chain A against A, TM-score 1.00

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