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Crystal structure of dimeric GCAMP3-D380Y, QP(LINKER 1), LP(LINKER 2)

Analyse Crystal structure of dimeric GCAMP3-D380Y, QP(LINKER 1), LP(LINKER 2) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3SG5
Type
protein
Length
387 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myosin light chain kinase, green fluorescent protein, calmodulin-1 chimera
UniProt
Q6LDG3, P42212, P0DP29
Ligands
CRO, CA, SO4
Pockets
3 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyosin light chain kinase, green fluorescent protein, calmodulin-1 chimeraprotein38734% helix, 32% strandQ6LDG3, P42212, P0DP29

Ligands and binding sites

  • CRO · {2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · ligand · chains A
  • CA · Calcium ion · metal · 4 copies · chains A
  • SO4 · Sulfate ion · ion · 4 copies · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15400.770.8451CRO
25330.640.7539empty
3580.320.7715empty

Modifications

Observed in the structure: 2 cofactor (chromophore).

Compared structures

  • 3SG5 · Crystal Structure of Dimeric GCaMP3-D380Y, QP(linker 1), LP(linker 2) · the same entry in another collection · chain A against A, TM-score 1.00
  • P42212 · AlphaFold monomer V2.0 prediction for green fluorescent protein (P42212) · a predicted model of the same protein · chain A against A, TM-score 0.37
  • P0DP29 · AlphaFold monomer V2.0 prediction for calmodulin-1 (P0DP29) · a predicted model of the same protein · chain A against A, TM-score 0.20

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