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2.1 ångström crystal structure of stage II sporulation protein D from bacillus anthracis
Analyse 2.1 ångström crystal structure of stage II sporulation protein D from bacillus… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 4RWR
- Type
- protein
- Length
- 535 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Stage II sporulation protein D
- UniProt
- Q81K14
- Pockets
- 5 · best druggability 0.70
Structure
x-ray diffraction · 2 distinct chains · 36% helix, 24% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Stage II sporulation protein D | protein | 267 | 36% helix, 24% strand | Q81K14 |
| B | Stage II sporulation protein D | protein | 268 | 36% helix, 23% strand | Q81K14 |
Pockets
5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 577 | 0.70 | 0.79 | 56 | empty |
| 2 | 600 | 0.67 | 0.77 | 65 | empty |
| 3 | 88 | 0.43 | 0.79 | 16 | empty |
| 4 | 56 | 0.36 | 0.78 | 10 | empty |
| 5 | 52 | 0.29 | 0.76 | 11 | empty |
Interfaces
1 interface between chains.
- A–B · 541 Ų buried · 12 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 12 modified (engineered).
Compared structures
- 4RWR · 2.1 Angstrom Crystal Structure of Stage II Sporulation Protein D from Bacillus anthracis · 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 Q81K14
- Elsewhere: RCSB PDB 4RWR · PDBe 4RWR · UniProt Q81K14
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