MolNFT v1 · #121413 · protein
Putative sugar kinases from synechococcus elongatus PCC7942 in complex with ADP
5HUX · Probable sugar kinase: “Putative sugar kinases from synechococcus elongatus PCC7942 in complex with ADP”. X-ray diffraction, 1 ligand (ADP), 4 pockets (best druggability 0.69). MolNFT v1 #121413 on GenesisL1: 3D structure, binding…
- PDB
- 5HUX
- Type
- protein
- Length
- 429 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Probable sugar kinase
- UniProt
- Q31KC7
- Ligands
- ADP
- Pockets
- 4 · best druggability 0.69
Structure
x-ray diffraction · 1 distinct chain · 32% helix, 22% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Probable sugar kinase | protein | 429 | 32% helix, 22% strand | Q31KC7 |
Ligands and binding sites
- ADP · Adenosine-5'-diphosphate · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
4 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 632 | 0.69 | 0.77 | 61 | empty |
| 2 | 101 | 0.46 | 0.79 | 21 | ADP |
| 3 | 50 | 0.44 | 0.84 | 14 | empty |
| 4 | 77 | 0.33 | 0.75 | 17 | empty |
Compared structures
- 5HUX · Putative sugar kinases from Synechococcus elongatus PCC7942 in complex with ADP · the same entry in another collection · chain A against A, TM-score 1.00
- Q31KC7 · AlphaFold monomer V2.0 prediction for D-ribulose kinase (Q31KC7) · a predicted model of the same protein · chain A against A, TM-score 0.98
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 Q31KC7
- Elsewhere: RCSB PDB 5HUX · PDBe 5HUX · UniProt Q31KC7
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