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Root induced secreted protein TSP1 from biocontrol fungi trichoderma virens

Analyse Root induced secreted protein TSP1 from biocontrol fungi trichoderma virens in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7CWJ
Type
protein
Length
515 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Root induced effector protein TSP1
UniProt
G9MQD3
Pockets
4 · best druggability 0.61

Structure

x-ray diffraction · 4 distinct chains · 8% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARoot induced effector protein TSP1protein1278% helix, 48% strandG9MQD3
BRoot induced effector protein TSP1protein1318% helix, 47% strandG9MQD3
CRoot induced effector protein TSP1protein12810% helix, 49% strandG9MQD3
DRoot induced effector protein TSP1protein1298% helix, 49% strandG9MQD3

Ligands and binding sites

  • GOL · Glycerol · additive · 4 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11930.610.8334GOL
2580.350.7814empty
3510.290.7616empty
4650.270.7320empty

Interfaces

5 interfaces between chains.

  • C–D · 1779 Ų buried · 21 hydrogen bonds · protein-protein
  • A–D · 269 Ų buried · 1 hydrogen bond · protein-protein
  • B–C · 220 Ų buried · 1 hydrogen bond · protein-protein
  • A–C · 137 Ų buried · 0 hydrogen bonds · protein-protein
  • B–D · 32 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide, 8 modified (disulfide, engineered).

Compared structures

  • 7CWJ · Root induced Secreted protein Tsp1 from Biocontrol fungi Trichoderma virens · the same entry in another collection · chain A against A, TM-score 1.00

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