MolNFT v1 · #46365 · protein
The crystal structure of a protein of unknown function from streptococcus agalactiae
2O2A · Hypothetical protein GBS1413: “The crystal structure of a protein of unknown function from streptococcus agalactiae”. X-ray diffraction, 3 pockets (best druggability 0.83). MolNFT v1 #46365 on GenesisL1: 3D structure, binding sites…
- PDB
- 2O2A
- Type
- protein
- Length
- 501 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Hypothetical protein GBS1413
- UniProt
- Q8E4I8
- Pockets
- 3 · best druggability 0.83
Structure
x-ray diffraction · 3 distinct chains · 30% helix, 42% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Hypothetical protein GBS1413 | protein | 125 | 29% helix, 41% strand | Q8E4I8 |
| B, C | Hypothetical protein GBS1413 | protein | 126 | 30% helix, 41% strand | Q8E4I8 |
| D | Hypothetical protein GBS1413 | protein | 124 | 30% helix, 43% strand | Q8E4I8 |
Pockets
3 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 398 | 0.83 | 0.91 | 64 | empty |
| 2 | 211 | 0.68 | 0.85 | 35 | empty |
| 3 | 100 | 0.66 | 0.90 | 22 | empty |
Interfaces
6 interfaces between chains.
- B–D · 1384 Ų buried · 12 hydrogen bonds · protein-protein
- A–B · 924 Ų buried · 16 hydrogen bonds · protein-protein
- C–D · 915 Ų buried · 16 hydrogen bonds · protein-protein
- A–D · 764 Ų buried · 4 hydrogen bonds · protein-protein
- B–C · 760 Ų buried · 3 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 8 modified (engineered).
Compared structures
- 2O2A · The crystal structure of a protein of unknown function from Streptococcus agalactiae · 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 Q8E4I8
- Elsewhere: RCSB PDB 2O2A · PDBe 2O2A · UniProt Q8E4I8
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