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Designed armadillo repeat protein internal LOCK2 fused to target peptide krkakitwkr

Analyse Designed armadillo repeat protein internal LOCK2 fused to target peptide… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6S9P
Type
protein
Length
672 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Internal LOCK2 fused to target peptide krkakitwkr
Pockets
4 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 73% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInternal LOCK2 fused to target peptide krkakitwkrprotein33872% helix, 0% strand—
BInternal LOCK2 fused to target peptide krkakitwkrprotein33475% helix, 0% strand—

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, B

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
18500.730.7882empty
23560.570.7644empty
3670.360.7714empty
4860.310.7317empty

Interfaces

1 interface between chains.

  • A–B · 654 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 6S9P · Designed Armadillo Repeat protein internal Lock2 fused to target peptide KRKAKITWKR · the same entry in another collection · chain A against A, TM-score 1.00

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