MolNFT v1 · #103330 · protein
Crystal structure of a trap periplasmic solute binding protein from polaromonas sp JS666 (BPRO_1871, target efi-510164) bound to D- erythronate
4PDH · Trap dicarboxylate transporter, dctp subunit: “Crystal structure of a trap periplasmic solute binding protein from polaromonas sp JS666 (BPRO_1871, target…”. X-ray diffraction, 1 ligand (EAX), 3 pockets (best druggability 0.30).…
- PDB
- 4PDH
- Type
- protein
- Length
- 301 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Trap dicarboxylate transporter, dctp subunit
- UniProt
- Q12CD8
- Ligands
- EAX
- Pockets
- 3 · best druggability 0.30
Structure
x-ray diffraction · 1 distinct chain · 51% helix, 22% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Trap dicarboxylate transporter, dctp subunit | protein | 301 | 51% helix, 22% strand | Q12CD8 |
Ligands and binding sites
- EAX · (2R,3R)-2,3,4-trihydroxybutanoic acid · ligand · 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, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 75 | 0.30 | 0.73 | 13 | empty |
| 2 | 53 | 0.29 | 0.75 | 12 | empty |
| 3 | 54 | 0.28 | 0.75 | 13 | empty |
Modifications
Observed in the structure: 1 modified (cyclization).
Compared structures
- 4PDH · CRYSTAL STRUCTURE OF A TRAP PERIPLASMIC SOLUTE BINDING PROTEIN FROM POLAROMONAS SP JS666… · 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 Q12CD8
- Elsewhere: RCSB PDB 4PDH · PDBe 4PDH · UniProt Q12CD8
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