MolNFT v1 · #105183 · protein
CRY3A toxin structure obtained by injecting bacillus thuringiensis cells in an xfel beam, collecting data by serial femtosecond crystallographic methods and processing data with the CCTBX.XFEL software suite
4QX2 · Pesticidal crystal protein CRY3AA: “CRY3A toxin structure obtained by injecting bacillus thuringiensis cells in an xfel beam, collecting data by…”. X-ray diffraction, 5 pockets (best druggability 0.69). MolNFT v1 #105183 on…
- PDB
- 4QX2
- Type
- protein
- Length
- 584 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Pesticidal crystal protein CRY3AA
- UniProt
- P0A379
- Pockets
- 5 · best druggability 0.69
Structure
x-ray diffraction · 1 distinct chain · 34% helix, 30% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Pesticidal crystal protein CRY3AA | protein | 584 | 34% helix, 30% strand | P0A379 |
Pockets
5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 296 | 0.69 | 0.84 | 34 | empty |
| 2 | 153 | 0.62 | 0.85 | 23 | empty |
| 3 | 216 | 0.52 | 0.77 | 32 | empty |
| 4 | 161 | 0.44 | 0.75 | 28 | empty |
| 5 | 59 | 0.29 | 0.75 | 22 | empty |
Compared structures
- 4QX2 · Cry3A Toxin structure obtained by injecting Bacillus thuringiensis cells in an XFEL beam… · the same entry in another collection · chain A against A, TM-score 1.00
- P0A379 · AlphaFold monomer V2.0 prediction for pesticidal crystal protein CRY3AA (P0A379) · a predicted model of the same protein · 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 P0A379
- Elsewhere: RCSB PDB 4QX2 · PDBe 4QX2 · UniProt P0A379
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