MolNFT v1 · #46778 · protein
Protein of unknown function (DUF964) from bacillus stearothermophilus
2OEQ · Protein of unknown function, DUF964: “Protein of unknown function (DUF964) from bacillus stearothermophilus”. X-ray diffraction, 2 pockets (best druggability 0.70). MolNFT v1 #46778 on GenesisL1: 3D structure, binding sites and…
- PDB
- 2OEQ
- Type
- protein
- Length
- 460 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Protein of unknown function, DUF964
- Pockets
- 2 · best druggability 0.70
Structure
x-ray diffraction · 4 distinct chains · 86% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Protein of unknown function, DUF964 | protein | 113 | 83% helix, 0% strand | — |
| B | Protein of unknown function, DUF964 | protein | 114 | 88% helix, 0% strand | — |
| C | Protein of unknown function, DUF964 | protein | 117 | 85% helix, 0% strand | — |
| D | Protein of unknown function, DUF964 | protein | 116 | 88% helix, 0% strand | — |
Pockets
2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 689 | 0.70 | 0.77 | 74 | empty |
| 2 | 715 | 0.70 | 0.77 | 40 | empty |
Interfaces
6 interfaces between chains.
- A–C · 2160 Ų buried · 17 hydrogen bonds · protein-protein
- B–D · 2147 Ų buried · 10 hydrogen bonds · protein-protein
- A–B · 1102 Ų buried · 14 hydrogen bonds · protein-protein
- C–D · 934 Ų buried · 13 hydrogen bonds · protein-protein
- A–D · 194 Ų buried · 1 hydrogen bond · protein-protein
Modifications
Observed in the structure: 28 modified (engineered).
Compared structures
- 2OEQ · Protein of Unknown Function (DUF964) from Bacillus stearothermophilus · 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
- Elsewhere: RCSB PDB 2OEQ · PDBe 2OEQ
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