MolNFT v1 · #48762 · protein
Beta-lactoglobulin (low humidity)
2Q39: “Beta-lactoglobulin (low humidity)”. X-ray diffraction, 6 pockets (best druggability 0.61). MolNFT v1 #48762 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 2Q39
- Type
- protein
- Length
- 311 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Beta-lactoglobulin
- UniProt
- P02754
- Pockets
- 6 · best druggability 0.61
Structure
x-ray diffraction · 2 distinct chains · 12% helix, 39% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Beta-lactoglobulin | protein | 160 | 11% helix, 38% strand | P02754 |
| B | Beta-lactoglobulin | protein | 151 | 12% helix, 41% strand | P02754 |
Pockets
6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 178 | 0.61 | 0.82 | 33 | empty |
| 2 | 237 | 0.50 | 0.75 | 30 | empty |
| 3 | 55 | 0.50 | 0.87 | 17 | empty |
| 4 | 121 | 0.47 | 0.79 | 30 | empty |
| 5 | 52 | 0.39 | 0.81 | 16 | empty |
Interfaces
1 interface between chains.
- A–B · 518 Ų buried · 12 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 2 disulfide (disulfide).
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 P02754
- Elsewhere: RCSB PDB 2Q39 · PDBe 2Q39 · UniProt P02754
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