MolNFT v1 · #152499 · protein
Enoyl-CoA HYDRATASE/ISOMERASE family protein from cupriavidus necator H16
6IJK: “Enoyl-CoA HYDRATASE/ISOMERASE family protein from cupriavidus necator H16”. X-ray diffraction, 7 pockets (best druggability 0.40). MolNFT v1 #152499 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6IJK
- Type
- protein
- Length
- 538 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Enoyl-CoA hydratase
- EC
- 4.2.1.17
- UniProt
- Q0K371
- Pockets
- 7 · best druggability 0.40
Structure
x-ray diffraction · 1 distinct chain · 44% helix, 16% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Enoyl-CoA hydratase (EC 4.2.1.17) | protein | 269 | 44% helix, 16% strand | Q0K371 |
Pockets
7 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 52 | 0.40 | 0.82 | 17 | empty |
| 2 | 91 | 0.33 | 0.73 | 17 | empty |
| 3 | 75 | 0.33 | 0.74 | 18 | empty |
| 4 | 66 | 0.32 | 0.75 | 19 | empty |
| 5 | 76 | 0.31 | 0.73 | 18 | empty |
Interfaces
1 interface between chains.
- A–B · 423 Ų buried · 16 hydrogen bonds · protein-protein
Compared structures
- 6IJK · Enoyl-CoA hydratase/isomerase family protein from Cupriavidus necator H16 · 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 Q0K371
- Elsewhere: RCSB PDB 6IJK · PDBe 6IJK · UniProt Q0K371
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