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MolNFT v1 · #117011 · protein

Crystal structure of unliganded periplasmic glucose binding protein (ppgbp) from P. putida CSV86

5DVF · Binding protein component of ABC sugar transporter: “Crystal structure of unliganded periplasmic glucose binding protein (ppgbp) from P. putida CSV86”. X-ray diffraction, 1 ligand (SO4), 10 pockets (best druggability 0.69). MolNFT…

PDB
5DVF
Type
protein
Length
778 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Binding protein component of ABC sugar transporter
UniProt
H7BRJ8
Ligands
SO4
Pockets
10 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BBinding protein component of ABC sugar transporterprotein38951% helix, 16% strandH7BRJ8

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

10 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17270.690.7776empty
22750.650.8230empty
33110.650.8132empty
4600.430.8217empty
5860.430.7917empty

Interfaces

1 interface between chains.

  • A–B · 632 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5DVF · Crystal structure of unliganded periplasmic glucose binding protein (ppGBP) from P.… · the same entry in another collection · chain A against A, TM-score 1.00

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