MolNFT v1 · #101515 · protein
Cdia-CT/CDII toxin and immunity complex from enterobacter cloacae
4NTQ · Contact-dependent inhibitor a: “Cdia-CT/CDII toxin and immunity complex from enterobacter cloacae”. X-ray diffraction, 2 pockets (best druggability 0.70). MolNFT v1 #101515 on GenesisL1: 3D structure, binding sites and pockets in…
- PDB
- 4NTQ
- Type
- protein
- Length
- 222 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Contact-dependent inhibitor a; Ecl cdii
- UniProt
- D5CBA0
- Pockets
- 2 · best druggability 0.70
Structure
x-ray diffraction · 2 distinct chains · 21% helix, 37% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Contact-dependent inhibitor a | protein | 76 | 9% helix, 32% strand | D5CBA0 |
| B | Ecl cdii | protein | 146 | 27% helix, 40% strand | — |
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 131 | 0.70 | 0.90 | 32 | empty |
| 2 | 69 | 0.37 | 0.78 | 14 | empty |
Interfaces
1 interface between chains.
- A–B · 1478 Ų buried · 22 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 5 modified (engineered).
Compared structures
- 4NTQ · CdiA-CT/CdiI toxin and immunity complex from Enterobacter cloacae · 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 D5CBA0
- Elsewhere: RCSB PDB 4NTQ · PDBe 4NTQ · UniProt D5CBA0
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