Research workbench
Crystal structure of a enoyl-CoA hydratase from shewanella pealeana atcc 700345
Analyse Crystal structure of a enoyl-CoA hydratase from shewanella pealeana atcc 700345 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 4KPK
- Type
- protein
- Length
- 265 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Enoyl-CoA HYDRATASE/ISOMERASE
- UniProt
- A8H6D2
- Pockets
- 3 · best druggability 0.64
Structure
x-ray diffraction · 1 distinct chain · 55% helix, 15% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Enoyl-CoA HYDRATASE/ISOMERASE | protein | 265 | 55% helix, 15% strand | A8H6D2 |
Ligands and binding sites
- EDO · 1,2-ethanediol · additive · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 287 | 0.64 | 0.80 | 31 | empty |
| 2 | 178 | 0.47 | 0.75 | 29 | empty |
| 3 | 73 | 0.31 | 0.74 | 19 | empty |
Modifications
Observed in the structure: 10 modified (engineered).
Compared structures
- 4KPK · Crystal structure of a enoyl-CoA hydratase from Shewanella pealeana ATCC 700345 · 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 A8H6D2
- Elsewhere: RCSB PDB 4KPK · PDBe 4KPK · UniProt A8H6D2
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