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Crystal structure of daucus carrot hypoglycemic peptide (dchp)

Analyse Crystal structure of daucus carrot hypoglycemic peptide (dchp) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7XKC
Type
protein
Length
331 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dchp
UniProt
A0A166C3G6
Ligands
SO4
Pockets
6 · best druggability 0.59

Structure

x-ray diffraction · 3 distinct chains · 17% helix, 37% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADchpprotein8417% helix, 37% strandA0A166C3G6
BDchpprotein7718% helix, 38% strandA0A166C3G6
C, DDchpprotein8516% helix, 36% strandA0A166C3G6

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 3 copies · chains A, B, D, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13420.590.7745SO4
21800.530.7926empty
31040.510.8218empty
41990.500.7629empty
51480.470.7724empty

Interfaces

3 interfaces between chains.

  • A–C · 958 Ų buried · 11 hydrogen bonds · protein-protein
  • B–D · 823 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 551 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7XKC · Crystal structure of Daucus Carrot hypoglycemic peptide (DCHP) · the same entry in another collection · chain A against A, TM-score 1.00

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