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MolNFT v1 · #172644 · protein

Complex of rice blast (magnaporthe oryzae) effector protein avr-pikc with the hma domain of pikh-1 from rice (oryza sativa)

7A8X · Nbs-lrr class disease resistance protein: “Complex of rice blast (magnaporthe oryzae) effector protein avr-pikc with the hma domain of pikh-1 from rice…”. X-ray diffraction, 4 pockets (best druggability 0.47). MolNFT v1 #172644 on…

PDB
7A8X
Type
protein
Length
453 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nbs-lrr class disease resistance protein; Avr-pik protein
UniProt
D5L9G5, G4MXW3
Pockets
4 · best druggability 0.47

Structure

x-ray diffraction · 5 distinct chains · 17% helix, 42% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANbs-lrr class disease resistance proteinprotein7229% helix, 38% strandD5L9G5
B, ENbs-lrr class disease resistance proteinprotein7428% helix, 38% strandD5L9G5
CAvr-pik proteinprotein800% helix, 48% strandG4MXW3
DNbs-lrr class disease resistance proteinprotein7130% helix, 41% strandD5L9G5
FAvr-pik proteinprotein824% helix, 46% strandG4MXW3

Pockets

4 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12080.470.7431empty
2580.340.7716empty
3680.320.7517empty
4600.300.7514empty

Interfaces

8 interfaces between chains.

  • E–F · 1075 Ų buried · 18 hydrogen bonds · protein-protein
  • B–C · 1045 Ų buried · 14 hydrogen bonds · protein-protein
  • D–E · 521 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 510 Ų buried · 9 hydrogen bonds · protein-protein
  • A–F · 374 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 7A8X · Complex of rice blast (Magnaporthe oryzae) effector protein AVR-PikC with the HMA domain… · the same entry in another collection · chain A against A, TM-score 1.00

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