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Crystal structure of peptide transporter dtpa-nanobody in mes buffer

Analyse Crystal structure of peptide transporter dtpa-nanobody in mes buffer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6GS1
Type
protein
Length
597 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dipeptide and tripeptide permease a; Nanobody 00
UniProt
P77304
Pockets
7 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 64% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADipeptide and tripeptide permease aprotein47280% helix, 1% strandP77304
HNanobody 00protein1252% helix, 46% strand—

Pockets

7 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110450.790.8072empty
21170.510.8123empty
31450.480.7720empty
41050.420.7817empty
5550.350.7711empty

Interfaces

1 interface between chains.

  • A–H · 915 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6GS1 · Crystal structure of peptide transporter DtpA-nanobody in MES buffer · the same entry in another collection · chain A against A, TM-score 1.00
  • P77304 · AlphaFold monomer V2.0 prediction for dipeptide and tripeptide permease a (P77304) · a predicted model of the same protein · chain A against A, TM-score 0.96

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