MolNFT v1 · #58203 · protein
Structure of a multicopper oxidase from the hyperthermophilic archaeon pyrobaculum aerophilum
3AW5: “Structure of a multicopper oxidase from the hyperthermophilic archaeon pyrobaculum aerophilum”. X-ray diffraction, 2 ligands (C2O, CU), 3 pockets (best druggability 0.52). MolNFT v1 #58203 on GenesisL1: 3D structure, binding sites…
- PDB
- 3AW5
- Type
- protein
- Length
- 438 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Multicopper oxidase
- EC
- 1.10.3.2
- UniProt
- Q8ZWA8
- Ligands
- C2O, CU
- Pockets
- 3 · best druggability 0.52
Structure
x-ray diffraction · 1 distinct chain · 8% helix, 47% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Multicopper oxidase (EC 1.10.3.2) | protein | 438 | 8% helix, 47% strand | Q8ZWA8 |
Ligands and binding sites
- C2O · Cu-O-Cu linkage · ligand · chains A
- CU · Copper (II) ion · metal · 2 copies · chains A
- ACT · Acetate ion · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 138 | 0.52 | 0.80 | 20 | empty |
| 2 | 120 | 0.44 | 0.77 | 26 | empty |
| 3 | 52 | 0.34 | 0.78 | 12 | empty |
Compared structures
- 3AW5 · Structure of a multicopper oxidase from the hyperthermophilic archaeon Pyrobaculum… · 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
- Every structure of UniProt Q8ZWA8
- Elsewhere: RCSB PDB 3AW5 · PDBe 3AW5 · UniProt Q8ZWA8
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