MolNFT v1 · #81254 · protein
Crystal structure of the TV3 mutant V134L
3UL8 · Toll-like receptor 4, variable lymphocyte receptor B: “Crystal structure of the TV3 mutant V134L”. X-ray diffraction, 4 ligands (NAG, BMA, FUL), 2 pockets (best druggability 0.65). MolNFT v1 #81254 on GenesisL1: 3D structure…
- PDB
- 3UL8
- Type
- protein
- Length
- 277 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Toll-like receptor 4, variable lymphocyte receptor B
- UniProt
- O00206, Q4G1L2
- Ligands
- NAG, BMA, FUL, SO4
- Pockets
- 2 · best druggability 0.65
Structure
x-ray diffraction · 1 distinct chain · 8% helix, 19% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Toll-like receptor 4, variable lymphocyte receptor B | protein | 277 | 8% helix, 19% strand | O00206, Q4G1L2 |
Ligands and binding sites
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 3 copies · chains A
- BMA · beta-D-mannopyranose · sugar
- FUL · beta-L-fucopyranose · sugar · chains A
- SO4 · Sulfate ion · ion · 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, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 63 | 0.65 | 0.93 | 19 | empty |
| 2 | 52 | 0.36 | 0.79 | 17 | empty |
Modifications
Observed in the structure: 3 disulfide, 2 glycan (disulfide, N-glycosylation).
Compared structures
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 O00206
- Every structure of UniProt Q4G1L2
- Elsewhere: RCSB PDB 3UL8 · PDBe 3UL8 · UniProt O00206 · UniProt Q4G1L2
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