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Cbs domain tandem of site-2 protease from archaeoglobus fulgidus in complex with llama nanobody - apo form

Analyse Cbs domain tandem of site-2 protease from archaeoglobus fulgidus in complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5G5R
Type
protein
Length
242 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Site-2 protease; Nanobody
EC
3.4.24.85
UniProt
O29915
Ligands
SO4
Pockets
3 · best druggability 0.49

Structure

x-ray diffraction · 2 distinct chains · 20% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASite-2 protease (EC 3.4.24.85)protein12234% helix, 26% strandO29915
BNanobodyprotein1205% helix, 50% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1600.490.8515empty
2570.370.7919SO4
3790.350.7612empty

Interfaces

1 interface between chains.

  • A–B · 790 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 5G5R · CBS domain tandem of site-2 protease from Archaeoglobus fulgidus in complex with llama… · the same entry in another collection · chain A against A, TM-score 1.00

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