MolNFT v1 · #71314 · protein
Mannohexaose complex of thermomonospora fusca beta-mannanase
3MAN · Protein (beta-mannanase): “Mannohexaose complex of thermomonospora fusca beta-mannanase”. X-ray diffraction, 2 ligands (BMA, MAN), 2 pockets (best druggability 0.63). MolNFT v1 #71314 on GenesisL1: 3D structure, binding sites and…
- PDB
- 3MAN
- Type
- protein
- Length
- 297 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Protein (beta-mannanase)
- Ligands
- BMA, MAN
- Pockets
- 2 · best druggability 0.63
Structure
x-ray diffraction · 1 distinct chain · 39% helix, 17% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Protein (beta-mannanase) | protein | 297 | 39% helix, 17% strand | — |
Ligands and binding sites
- BMA · beta-D-mannopyranose · sugar · 2 copies · chains A
- MAN · alpha-D-mannopyranose · sugar · 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 | 55 | 0.63 | 0.94 | 20 | empty |
| 2 | 172 | 0.44 | 0.74 | 23 | MAN |
Modifications
Observed in the structure: 1 disulfide (disulfide).
Compared structures
- 3MAN · Mannohexaose complex of thermomonospora fusca beta-mannanase · 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 3MAN · PDBe 3MAN
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