Research workbench
Dissection of mannosylglycerate synthase: an archetypal mannosyltransferase
Analyse Dissection of mannosylglycerate synthase: an archetypal mannosyltransferase in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 2BO4
- Type
- protein
- Length
- 2,280 residues
- Chains
- 6
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mannosylglycerate synthase
- EC
- 2.4.1.-
- UniProt
- Q9RFR0
- Pockets
- 15 · best druggability 0.88
Structure
x-ray diffraction · 1 distinct chain · 54% helix, 10% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C, D, E, F | Mannosylglycerate synthase (EC 2.4.1.-) | protein | 380 | 54% helix, 10% strand | Q9RFR0 |
Ligands and binding sites
- FLC · Citrate anion · additive · 6 copies · chains A, B, C, D, E, F
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
15 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 941 | 0.88 | 0.90 | 140 | FLC |
| 2 | 643 | 0.86 | 0.91 | 85 | empty |
| 3 | 1083 | 0.81 | 0.82 | 112 | FLC |
| 4 | 499 | 0.75 | 0.83 | 46 | FLC |
| 5 | 522 | 0.75 | 0.83 | 46 | FLC |
Interfaces
8 interfaces between chains.
- A–F · 1321 Ų buried · 16 hydrogen bonds · protein-protein
- B–E · 1316 Ų buried · 16 hydrogen bonds · protein-protein
- A–B · 1171 Ų buried · 10 hydrogen bonds · protein-protein
- E–F · 1171 Ų buried · 10 hydrogen bonds · protein-protein
- C–D · 1167 Ų buried · 10 hydrogen bonds · protein-protein
Compared structures
- 2BO4 · Dissection of mannosylglycerate synthase: an archetypal mannosyltransferase · the same entry in another collection · chain C against C, TM-score 1.00
- Q9RFR0 · AlphaFold monomer V2.0 prediction for mannosylglycerate synthase (Q9RFR0) · a predicted model of the same protein · chain A against A, TM-score 0.99
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 Q9RFR0
- Elsewhere: RCSB PDB 2BO4 · PDBe 2BO4 · UniProt Q9RFR0
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