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Crystal structure of wt cgmp dependent protein kinase I alpha (pkgi alpha) leucine zipper

Analyse Crystal structure of wt cgmp dependent protein kinase I alpha (pkgi alpha)… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4R4L
Type
protein
Length
143 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cgmp-dependent protein kinase 1
UniProt
Q13976
Ligands
SO4

Structure

x-ray diffraction · 2 distinct chains · 91% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCgmp-dependent protein kinase 1protein4791% helix, 0% strandQ13976
CCgmp-dependent protein kinase 1protein4990% helix, 0% strandQ13976

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains B
  • HEZ · Hexane-1,6-diol · additive · 2 copies · chains A, B

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

Interfaces

3 interfaces between chains.

  • A–B · 1346 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 754 Ų buried · 11 hydrogen bonds · protein-protein
  • A–C · 90 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 4R4L · Crystal structure of wt cGMP dependent protein kinase I alpha (PKGI alpha) leucine zipper · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13976 · AlphaFold monomer V2.0 prediction for cgmp-dependent protein kinase 1 (Q13976) · a predicted model of the same protein · chain A against A, TM-score 0.91

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