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Hypothetical extein protein of PH1602 from pyrococcus horikoshii

Analyse Hypothetical extein protein of PH1602 from pyrococcus horikoshii in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1UC2
Type
protein
Length
960 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hypothetical protein PH1602
UniProt
O59245
Ligands
GLC, FRU, SO4
Pockets
6 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 37% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BHypothetical protein PH1602protein48037% helix, 24% strandO59245

Ligands and binding sites

  • GLC · alpha-D-glucopyranose · sugar · 2 copies · chains A, B
  • FRU · beta-D-fructofuranose · sugar · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 9 copies · chains A, B

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

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19390.770.8071SO4
211880.760.7997SO4
31720.640.8526empty
4510.280.7512empty
5650.270.7222empty

Interfaces

1 interface between chains.

  • A–B · 1337 Ų buried · 19 hydrogen bonds · protein-protein

Compared structures

  • 1UC2 · Hypothetical Extein Protein of PH1602 from Pyrococcus horikoshii · the same entry in another collection · chain A against A, TM-score 1.00
  • O59245 · AlphaFold monomer V2.0 prediction for RNA-splicing ligase rtcb (O59245) · a predicted model of the same protein · chain A against A, TM-score 0.99

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