MolNFT v1 · #78323 · protein
Crystal structure of human 4-hydroxy-2-oxoglutarate aldolase bound to pyruvate
3S5O · 4-hydroxy-2-oxoglutarate aldolase, mitochondrial: “Crystal structure of human 4-hydroxy-2-oxoglutarate aldolase bound to pyruvate”. X-ray diffraction, 1 ligand (K), 1 pocket (best druggability 0.56). MolNFT v1 #78323 on GenesisL1…
- PDB
- 3S5O
- Type
- protein
- Length
- 296 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- 4-hydroxy-2-oxoglutarate aldolase, mitochondrial
- EC
- 4.1.3.16
- UniProt
- Q86XE5
- Ligands
- K
- Pockets
- 1 · best druggability 0.56
Structure
x-ray diffraction · 1 distinct chain · 52% helix, 13% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | 4-hydroxy-2-oxoglutarate aldolase, mitochondrial (EC 4.1.3.16) | protein | 296 | 52% helix, 13% strand | Q86XE5 |
Ligands and binding sites
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 278 | 0.56 | 0.77 | 39 | EDO |
Modifications
Observed in the structure: 1 modified (nonstandard).
Compared structures
- 3S5O · Crystal Structure of Human 4-hydroxy-2-oxoglutarate Aldolase Bound to Pyruvate · the same entry in another collection · chain A against A, TM-score 1.00
- Q86XE5 · AlphaFold monomer V2.0 prediction for 4-hydroxy-2-oxoglutarate aldolase, mitochondrial… · 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 Q86XE5
- Elsewhere: RCSB PDB 3S5O · PDBe 3S5O · UniProt Q86XE5
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