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Crystal structure of the cysteine-rich domain of secreted frizzled- related protein 3 (sfrp-3;FZB)

Analyse Crystal structure of the cysteine-rich domain of secreted frizzled- related… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1IJX
Type
protein
Length
740 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Secreted frizzled-related sequence protein 3
UniProt
P97401
Ligands
SO4
Pockets
7 · best druggability 0.64

Structure

x-ray diffraction · 4 distinct chains · 41% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, FSecreted frizzled-related sequence protein 3protein12540% helix, 10% strandP97401
BSecreted frizzled-related sequence protein 3protein12040% helix, 11% strandP97401
DSecreted frizzled-related sequence protein 3protein12241% helix, 6% strandP97401
ESecreted frizzled-related sequence protein 3protein12341% helix, 11% strandP97401

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15360.640.7656empty
23350.560.7528empty
32950.550.7645empty
41030.400.7614empty
5790.390.7820empty

Interfaces

8 interfaces between chains.

  • A–C · 1209 Ų buried · 18 hydrogen bonds · protein-protein
  • B–E · 1179 Ų buried · 17 hydrogen bonds · protein-protein
  • A–B · 495 Ų buried · 1 hydrogen bond · protein-protein
  • C–D · 333 Ų buried · 0 hydrogen bonds · protein-protein
  • D–E · 302 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 30 disulfide (disulfide).

Compared structures

  • 1IJX · Crystal structure of the cysteine-rich domain of secreted frizzled-related protein 3… · the same entry in another collection · chain F against F, TM-score 1.00
  • P97401 · AlphaFold monomer V2.0 prediction for secreted frizzled-related protein 3 (P97401) · a predicted model of the same protein · chain B against A, TM-score 0.91

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