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Crystal structure of the sugar acid binding protein dctpam from advenella mimigardefordensis strain DPN7T in complex with D-foconate

Analyse Crystal structure of the sugar acid binding protein dctpam from advenella… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7BCO
Type
protein
Length
620 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative trap transporter solute receptor dctp
UniProt
R4JTF7
Ligands
TF8
Pockets
8 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 53% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPutative trap transporter solute receptor dctpprotein31053% helix, 20% strandR4JTF7

Ligands and binding sites

  • TF8 · (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanoic acid · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1600.700.9721TF8
2570.700.9721TF8
32640.590.7927empty
41150.500.8036empty
52160.470.7419empty

Interfaces

1 interface between chains.

  • A–B · 508 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 7BCO · Crystal structure of the sugar acid binding protein DctPAm from Advenella… · the same entry in another collection · chain A against A, TM-score 1.00

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