MolNFT v1 · #55323 · protein
Wif domain-epidermal growth factor (EGF)-like domains 1-3 of human wnt inhibitory factor 1 in complex with 1,2- dipalmitoylphosphatidylcholine
2YGQ: “Wif domain-epidermal growth factor (EGF)-like domains 1-3 of human wnt inhibitory factor 1 in complex with…”. X-ray diffraction, 5 ligands (GU4, YYJ, PCF), 3 pockets (best druggability 0.82). MolNFT v1 #55323 on GenesisL1: 3D…
- PDB
- 2YGQ
- Type
- protein
- Length
- 241 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Wnt inhibitory factor 1
- UniProt
- Q9Y5W5
- Ligands
- GU4, YYJ, PCF, NAG, FUC
- Pockets
- 3 · best druggability 0.82
Structure
x-ray diffraction · 1 distinct chain · 7% helix, 32% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Wnt inhibitory factor 1 | protein | 241 | 7% helix, 32% strand | Q9Y5W5 |
Ligands and binding sites
- GU4 · 2,3,4,6-tetra-O-sulfonato-alpha-D-glucopyranose · ligand · chains A
- YYJ · 1,3,4,6-tetra-O-sulfo-beta-D-fructofuranose · ligand
- PCF · 1,2-diacyl-sn-glycero-3-phoshocholine · ligand · chains A
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 copies · chains A
- FUC · alpha-L-fucopyranose · sugar · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 551 | 0.82 | 0.87 | 46 | PCF |
| 2 | 462 | 0.60 | 0.75 | 52 | empty |
| 3 | 172 | 0.50 | 0.77 | 21 | empty |
Modifications
Observed in the structure: 10 disulfide, 3 glycan (disulfide, N-glycosylation, O-glycosylation).
Compared structures
- 2YGQ · WIF domain-epidermal growth factor (EGF)-like domains 1-3 of human Wnt inhibitory factor… · the same entry in another collection · chain A against A, TM-score 1.00
- Q9Y5W5 · AlphaFold monomer V2.0 prediction for wnt inhibitory factor 1 (Q9Y5W5) · a predicted model of the same protein · chain A against A, TM-score 0.65
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q9Y5W5
- Elsewhere: RCSB PDB 2YGQ · PDBe 2YGQ · UniProt Q9Y5W5
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