MolNFT v1 · #120439 · protein
Name to be released when published
5H0I · Asparaginyl endopeptidase: “Name to be released when published”. X-ray diffraction, 9 pockets (best druggability 0.51). MolNFT v1 #120439 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 5H0I
- Type
- protein
- Length
- 800 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Asparaginyl endopeptidase
- EC
- 3.4.22.34
- UniProt
- A0A0N9JZ32
- Pockets
- 9 · best druggability 0.51
Structure
x-ray diffraction · 2 distinct chains · 43% helix, 13% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Asparaginyl endopeptidase (EC 3.4.22.34) | protein | 400 | 44% helix, 13% strand | A0A0N9JZ32 |
| B | Asparaginyl endopeptidase (EC 3.4.22.34) | protein | 400 | 43% helix, 13% strand | A0A0N9JZ32 |
Pockets
9 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 163 | 0.51 | 0.79 | 34 | empty |
| 2 | 172 | 0.50 | 0.78 | 31 | empty |
| 3 | 144 | 0.47 | 0.77 | 34 | empty |
| 4 | 67 | 0.44 | 0.82 | 22 | empty |
| 5 | 93 | 0.32 | 0.73 | 20 | empty |
Interfaces
1 interface between chains.
- A–B · 737 Ų buried · 7 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 4 disulfide (disulfide).
Compared structures
- 5H0I · Structure of OaAEP1 asparaginyl peptide ligase in its proenzyme form · 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 A0A0N9JZ32
- Elsewhere: RCSB PDB 5H0I · PDBe 5H0I · UniProt A0A0N9JZ32
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