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Crystal structure of a trap periplasmic solute binding protein from polaromonas sp. JS666 (BPRO_4736), target efi-510156, with bound benzoyl formate, space group P6522

Analyse Crystal structure of a trap periplasmic solute binding protein from polaromonas… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4MNI
Type
protein
Length
304 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Trap dicarboxylate transporter-dctp subunit
UniProt
Q122C7
Ligands
173
Pockets
1 · best druggability 0.31

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATrap dicarboxylate transporter-dctp subunitprotein30451% helix, 19% strandQ122C7

Ligands and binding sites

  • 173 · Benzoyl-formic acid · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1830.310.7316empty

Compared structures

  • 4MNI · 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
  • Q122C7 · AlphaFold monomer V2.0 prediction for solute-binding protein BPRO_4736 (Q122C7) · a predicted model of the same protein · chain A against A, TM-score 0.98

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