MolNFT v1 · #171099 · protein
Glycosylated KNOB/DUMMY-HOLE/DUMMY Fc fragment
6YTB · Immunoglobulin gamma-1 heavy chain: “Glycosylated KNOB/DUMMY-HOLE/DUMMY Fc fragment”. X-ray diffraction, 5 ligands (NAG, MAN, BMA), 3 pockets (best druggability 0.37). MolNFT v1 #171099 on GenesisL1: 3D structure, binding sites and…
- PDB
- 6YTB
- Type
- protein
- Length
- 416 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Immunoglobulin gamma-1 heavy chain
- UniProt
- P0DOX5
- Ligands
- NAG, MAN, BMA, GAL, FUC
- Pockets
- 3 · best druggability 0.37
Structure
x-ray diffraction · 2 distinct chains · 11% helix, 48% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Immunoglobulin gamma-1 heavy chain | protein | 207 | 11% helix, 48% strand | P0DOX5 |
| B | Immunoglobulin gamma-1 heavy chain | protein | 209 | 10% helix, 47% strand | P0DOX5 |
Ligands and binding sites
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B
- MAN · alpha-D-mannopyranose · sugar · 4 copies · chains A, B
- BMA · beta-D-mannopyranose · sugar · 2 copies · chains A, B
- GAL · beta-D-galactopyranose · sugar · 2 copies · chains A, B
- FUC · alpha-L-fucopyranose · sugar · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 86 | 0.37 | 0.77 | 18 | empty |
| 2 | 80 | 0.31 | 0.73 | 20 | empty |
| 3 | 55 | 0.29 | 0.76 | 18 | empty |
Interfaces
1 interface between chains.
- A–B · 1137 Ų buried · 7 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 4 disulfide, 2 glycan (disulfide, N-glycosylation).
Compared structures
- 6YTB · Glycosylated KNOB/DUMMY-HOLE/DUMMY Fc fragment · the same entry in another collection · chain A against A, TM-score 1.00
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 P0DOX5
- Elsewhere: RCSB PDB 6YTB · PDBe 6YTB · UniProt P0DOX5
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