Research workbench
Structure of a GH3 B-glucosidase from cow rumen metagenome in complex with galactose
Analyse Structure of a GH3 B-glucosidase from cow rumen metagenome in complex with… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 5K6O
- Type
- protein
- Length
- 795 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- B-glucosidase
- EC
- 3.2.1.21
- Ligands
- GAL, SO4
- Pockets
- 7 · best druggability 0.62
Structure
x-ray diffraction · 1 distinct chain · 30% helix, 23% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | B-glucosidase (EC 3.2.1.21) | protein | 795 | 30% helix, 23% strand | — |
Ligands and binding sites
- GAL · beta-D-galactopyranose · sugar · chains A
- SO4 · Sulfate ion · ion · 8 copies · chains A
- EDO · 1,2-ethanediol · additive · 2 copies · 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, 4 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 270 | 0.62 | 0.80 | 46 | empty |
| 2 | 122 | 0.55 | 0.83 | 17 | empty |
| 3 | 276 | 0.53 | 0.75 | 33 | SO4 |
| 4 | 82 | 0.52 | 0.84 | 18 | GAL |
| 5 | 177 | 0.44 | 0.74 | 30 | empty |
Compared structures
- 5K6O · Structure of a GH3 b-glucosidase from cow rumen metagenome in complex with galactose · 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
- Elsewhere: RCSB PDB 5K6O · PDBe 5K6O
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