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X-ray crystallographic studies on hexameric insulins in the presence of helix-stabilizing agents, thiocyanate, methylparaben and phenol

Analyse X-ray crystallographic studies on hexameric insulins in the presence of… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MTH
Type
protein
Length
100 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methylparaben insulin
UniProt
P01315
Ligands
MPB, ZN, CL

Structure

x-ray diffraction · 3 distinct chains · 59% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CMethylparaben insulinprotein2162% helix, 5% strandP01315
BMethylparaben insulinprotein2868% helix, 11% strandP01315
DMethylparaben insulinprotein3050% helix, 10% strandP01315

Ligands and binding sites

  • MPB · 4-hydroxy-benzoic acid methyl ester · ligand · chains A, B
  • ZN · Zinc ion · metal · 2 copies · chains B, D
  • CL · Chloride ion · ion · 2 copies · chains B, D

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

Interfaces

5 interfaces between chains.

  • C–D · 841 Ų buried · 11 hydrogen bonds · protein-protein
  • B–D · 728 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 564 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 69 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 35 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 3MTH · X-ray crystallographic studies on hexameric insulins in the presence of helix-stabilizing… · the same entry in another collection · chain A against A, TM-score 1.00

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