MolNFT v1 · #113310 · protein
Crystal structure analysis of fungal versatile peroxidase from pleurotus eryngii. mutant vpi-br. mutated residues T2K, D69S, T70D, S86E, A131K, D146T, Q202L, Q219K, H232E, Q239R, L288R, S301K, A308R, A309K and A314R.
5ABO · Versatile peroxidase VPL2: “Crystal structure analysis of fungal versatile peroxidase from pleurotus eryngii. mutant vpi-br. mutated…”. X-ray diffraction, 2 ligands (HEM, CA), 1 pocket (best druggability 0.81). MolNFT v1 #113310 on…
- PDB
- 5ABO
- Type
- protein
- Length
- 315 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Versatile peroxidase VPL2
- EC
- 1.11.1.16
- UniProt
- O94753
- Ligands
- HEM, CA
- Pockets
- 1 · best druggability 0.81
Structure
x-ray diffraction · 1 distinct chain · 43% helix, 6% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Versatile peroxidase VPL2 (EC 1.11.1.16) | protein | 315 | 43% helix, 6% strand | O94753 |
Ligands and binding sites
- HEM · Protoporphyrin IX containing Fe · ligand · chains A
- CA · Calcium ion · metal · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 463 | 0.81 | 0.88 | 47 | HEM |
Modifications
Observed in the structure: 4 disulfide (disulfide).
Compared structures
- 5ABO · CRYSTAL STRUCTURE ANALYSIS OF FUNGAL VERSATILE PEROXIDASE FROM PLEUROTUS ERYNGII. MUTANT… · the same entry in another collection · chain A against A, TM-score 1.00
- O94753 · AlphaFold monomer V2.0 prediction for versatile peroxidase VPL2 (O94753) · 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 O94753
- Elsewhere: RCSB PDB 5ABO · PDBe 5ABO · UniProt O94753
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