MolNFT v1 · #12568 · protein
Structure of P. citrinum alpha 1,2-mannosidase reveals the basis for differences in specificity of the er and golgi class I enzymes
1KKT · Mannosyl-oligosaccharide alpha-1,2-mannosidase: “Structure of P. citrinum alpha 1,2-mannosidase reveals the basis for differences in specificity of the er and…”. X-ray diffraction, 3 ligands (NAG, MAN, CA), 5 pockets (best…
- PDB
- 1KKT
- Type
- protein
- Length
- 950 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Mannosyl-oligosaccharide alpha-1,2-mannosidase
- EC
- 3.2.1.113
- UniProt
- P31723
- Ligands
- NAG, MAN, CA
- Pockets
- 5 · best druggability 0.79
Structure
x-ray diffraction · 1 distinct chain · 52% helix, 11% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Mannosyl-oligosaccharide alpha-1,2-mannosidase (EC 3.2.1.113) | protein | 475 | 52% helix, 11% strand | P31723 |
Ligands and binding sites
- NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 12 copies · chains A, B
- MAN · alpha-D-mannopyranose · sugar · 6 copies · chains A, B
- CA · Calcium ion · metal · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 659 | 0.79 | 0.84 | 77 | empty |
| 2 | 136 | 0.61 | 0.85 | 25 | CA |
| 3 | 107 | 0.60 | 0.86 | 21 | CA |
| 4 | 65 | 0.43 | 0.82 | 19 | empty |
| 5 | 56 | 0.41 | 0.82 | 18 | empty |
Interfaces
1 interface between chains.
- A–B · 877 Ų buried · 8 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 6 glycan, 2 disulfide (N-glycosylation, disulfide).
Compared structures
- 1KKT · Structure of P. citrinum alpha 1,2-mannosidase reveals the basis for differences in… · the same entry in another collection · chain A against A, TM-score 1.00
- P31723 · AlphaFold monomer V2.0 prediction for mannosyl-oligosaccharide alpha-1,2-mannosidase… · a predicted model of the same protein · 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 P31723
- Elsewhere: RCSB PDB 1KKT · PDBe 1KKT · UniProt P31723
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