GL1X · GenesisL1 explorer

MolNFT v1 · #163344 · protein

Crystal structure of properdin (tsr domains N1 & 456)

6S08: “Crystal structure of properdin (tsr domains N1 & 456)”. X-ray diffraction, 4 ligands (MAN, FUC, BGC), 2 pockets (best druggability 0.39). MolNFT v1 #163344 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6S08
Type
protein
Length
311 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Properdin
UniProt
P27918
Ligands
MAN, FUC, BGC, NA
Pockets
2 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 1% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProperdinprotein2060% helix, 36% strandP27918
BProperdinprotein1054% helix, 50% strandP27918

Ligands and binding sites

  • MAN · alpha-D-mannopyranose · sugar · 8 copies · chains A, B
  • FUC · alpha-L-fucopyranose · sugar · 2 copies · chains A, B
  • BGC · beta-D-glucopyranose · sugar · chains A, B
  • NA · Sodium ion · metal · chains A
  • PGE · Triethylene glycol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11170.390.7527empty
21070.370.7520empty

Interfaces

1 interface between chains.

  • A–B · 1248 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 disulfide, 10 glycan (disulfide, C-mannosylation, O-glycosylation).

Compared structures

  • 6S08 · Crystal Structure of Properdin (TSR domains N1 & 456) · the same entry in another collection · chain A against A, TM-score 1.00
  • P27918 · AlphaFold monomer V2.0 prediction for properdin (P27918) · a predicted model of the same protein · chain B against A, TM-score 0.92

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