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MolNFT v1 · #153806 · protein

Crystal structure of phyllogen, a phyllody inducing effector protein of phytoplasma.

6JQA · Phytoplasmal effector causing phyllody 1: “Crystal structure of phyllogen, a phyllody inducing effector protein of phytoplasma.”. X-ray diffraction, 1 ligand (IOD), 4 pockets (best druggability 0.86). MolNFT v1 #153806 on GenesisL1…

PDB
6JQA
Type
protein
Length
335 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phytoplasmal effector causing phyllody 1
UniProt
X5IFG3
Ligands
IOD
Pockets
4 · best druggability 0.86

Structure

x-ray diffraction · 4 distinct chains · 75% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhytoplasmal effector causing phyllody 1protein8575% helix, 0% strandX5IFG3
BPhytoplasmal effector causing phyllody 1protein8873% helix, 0% strandX5IFG3
CPhytoplasmal effector causing phyllody 1protein8173% helix, 0% strandX5IFG3
DPhytoplasmal effector causing phyllody 1protein8179% helix, 0% strandX5IFG3

Ligands and binding sites

  • IOD · Iodide ion · ion · 19 copies · chains A, B, D, C

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15660.860.9167empty
22370.640.8229empty
31240.470.7919empty
4700.340.7617IOD

Interfaces

6 interfaces between chains.

  • A–B · 1181 Ų buried · 17 hydrogen bonds · protein-protein
  • C–D · 1143 Ų buried · 16 hydrogen bonds · protein-protein
  • A–C · 960 Ų buried · 7 hydrogen bonds · protein-protein
  • B–D · 695 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 505 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 11 modified (nonstandard).

Compared structures

  • 6JQA · Crystal structure of phyllogen, a phyllody inducing effector protein of phytoplasma. · the same entry in another collection · chain A against A, TM-score 1.00

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