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Crystal structure of DSCAM1 isoform 7.44, N-terminal four ig domains

Analyse Crystal structure of DSCAM1 isoform 7.44, N-terminal four ig domains in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4X83
Type
protein
Length
1,558 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Down syndrome cell adhesion molecule, isoform 7.44
Ligands
NAG, CL
Pockets
12 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 5% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CDown syndrome cell adhesion molecule, isoform 7.44protein3894% helix, 53% strand—
DDown syndrome cell adhesion molecule, isoform 7.44protein3915% helix, 54% strand—

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 11 copies · chains A, B, C, D
  • CL · Chloride ion · ion · 2 copies · chains B, C

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

Pockets

12 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16340.790.8492empty
25450.740.8267empty
31510.680.8836empty
42710.670.8338empty
52870.660.8236empty

Interfaces

5 interfaces between chains.

  • A–B · 1310 Ų buried · 16 hydrogen bonds · protein-protein
  • C–D · 1245 Ų buried · 16 hydrogen bonds · protein-protein
  • B–C · 583 Ų buried · 10 hydrogen bonds · protein-protein
  • B–D · 172 Ų buried · 0 hydrogen bonds · protein-protein
  • A–C · 98 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 disulfide, 7 glycan (disulfide, N-glycosylation).

Compared structures

  • 4X83 · Crystal structure of Dscam1 isoform 7.44, N-terminal four Ig domains · the same entry in another collection · chain A against A, TM-score 1.00

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