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Crystal structure of dc-sign in complex with a triazole-based glycomimetic ligand

Analyse Crystal structure of dc-sign in complex with a triazole-based glycomimetic… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7NL6
Type
protein
Length
132 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dc-sign, crd domain
UniProt
Q9NNX6
Ligands
UH8, CA, NO3

Structure

x-ray diffraction · 1 distinct chain · 22% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADc-sign, crd domainprotein13222% helix, 30% strandQ9NNX6

Ligands and binding sites

  • UH8 · Methyl 2-deoxy-2-(4-(pyridine-3-yl))-1,2,3-triazol-1-yl)-alpha-D-mannopyranoside · ligand · chains A
  • CA · Calcium ion · metal · 3 copies · chains A
  • NO3 · Nitrate ion · ion · chains A

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

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7NL6 · Crystal Structure of DC-SIGN in complex with a triazole-based glycomimetic ligand · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NNX6 · AlphaFold monomer V2.0 prediction for CD209 antigen (Q9NNX6) · a predicted model of the same protein · chain A against A, TM-score 0.99

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