Research workbench
The type ie CRISPR cascade complex from E. COLI, with two assemblies in the asymmetric unit arranged back-to-back
Analyse The type ie CRISPR cascade complex from E. COLI, with two assemblies in the… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 5CD4
- Type
- protein + RNA
- Length
- 6,840 residues
- Chains
- 24
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- CRISPR system cascade subunit case; CRISPR system cascade subunit casc; CRISPR system…
- EC
- 3.1.-.-
- UniProt
- Q46897, Q46899, Q46898, Q46901, P76632
- Ligands
- ZN
- Pockets
- 20 · best druggability 0.85
Structure
x-ray diffraction · 22 distinct chains · 39% helix, 21% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | CRISPR system cascade subunit case (EC 3.1.-.-) | protein | 199 | 20% helix, 43% strand | Q46897 |
| B | CRISPR system cascade subunit casc | protein | 357 | 41% helix, 18% strand | Q46899 |
| C | CRISPR system cascade subunit casc | protein | 356 | 38% helix, 23% strand | Q46899 |
| D | CRISPR system cascade subunit casc | protein | 355 | 38% helix, 24% strand | Q46899 |
| E | CRISPR system cascade subunit casc | protein | 362 | 38% helix, 23% strand | Q46899 |
| F | CRISPR system cascade subunit casc | protein | 363 | 37% helix, 23% strand | Q46899 |
| G | CRISPR system cascade subunit casc | protein | 362 | 38% helix, 20% strand | Q46899 |
| H, T | CRISPR system cascade subunit casd | protein | 219 | 16% helix, 37% strand | Q46898 |
| I | CRISPR system cascade subunit casa | protein | 494 | 40% helix, 16% strand | Q46901 |
| J | CRISPR system cascade subunit casb | protein | 156 | 63% helix, 3% strand | P76632 |
| K | CRISPR system cascade subunit casb | protein | 154 | 66% helix, 3% strand | P76632 |
| L, X | Crrna | rna | 61 | — | — |
| M | CRISPR system cascade subunit case (EC 3.1.-.-) | protein | 192 | 23% helix, 43% strand | Q46897 |
| N | CRISPR system cascade subunit casc | protein | 356 | 40% helix, 19% strand | Q46899 |
| O | CRISPR system cascade subunit casc | protein | 351 | 38% helix, 23% strand | Q46899 |
| P | CRISPR system cascade subunit casc | protein | 359 | 38% helix, 23% strand | Q46899 |
| Q | CRISPR system cascade subunit casc | protein | 359 | 38% helix, 25% strand | Q46899 |
| R | CRISPR system cascade subunit casc | protein | 357 | 39% helix, 23% strand | Q46899 |
| S | CRISPR system cascade subunit casc | protein | 353 | 39% helix, 20% strand | Q46899 |
| U | CRISPR system cascade subunit casa | protein | 492 | 40% helix, 16% strand | Q46901 |
| V | CRISPR system cascade subunit casb | protein | 152 | 65% helix, 3% strand | P76632 |
| W | CRISPR system cascade subunit casb | protein | 151 | 66% helix, 3% strand | P76632 |
Ligands and binding sites
- ZN · Zinc ion · metal · 2 copies · chains I, U
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 965 | 0.85 | 0.86 | 119 | empty |
| 2 | 1199 | 0.82 | 0.83 | 115 | empty |
| 3 | 1042 | 0.81 | 0.83 | 130 | empty |
| 4 | 856 | 0.79 | 0.82 | 105 | empty |
| 5 | 171 | 0.78 | 0.94 | 26 | empty |
Interfaces
70 interfaces between chains.
- S–T · 2220 Ų buried · 19 hydrogen bonds · protein-protein
- G–H · 2204 Ų buried · 20 hydrogen bonds · protein-protein
- D–E · 2023 Ų buried · 27 hydrogen bonds · protein-protein
- C–D · 1989 Ų buried · 29 hydrogen bonds · protein-protein
- R–S · 1975 Ų buried · 29 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 3 disulfide, 2 modified (disulfide, nucleotide modification).
Compared structures
- 5CD4 · The Type IE CRISPR Cascade complex from E. coli, with two assemblies in the asymmetric… · the same entry in another collection · chain J against J, 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 Q46897
- Every structure of UniProt Q46899
- Every structure of UniProt Q46898
- Every structure of UniProt Q46901
- Every structure of UniProt P76632
- Elsewhere: RCSB PDB 5CD4 · PDBe 5CD4 · UniProt Q46897 · UniProt Q46899 · UniProt Q46898 · UniProt Q46901 · UniProt P76632
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