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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).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATrap dicarboxylate transporter, dctp subunitprotein30151% helix, 22% strandQ12CD8

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.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1750.300.7313empty
2530.290.7512empty
3540.280.7513empty

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

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