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Fluorescent protein cyofp

Analyse Fluorescent protein cyofp in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5BQL
Type
protein
Length
890 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fluorescent protein cyofp
Ligands
NRQ
Pockets
14 · best druggability 0.83

Structure

x-ray diffraction · 4 distinct chains · 6% helix, 56% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFluorescent protein cyofpprotein2256% helix, 56% strand—
BFluorescent protein cyofpprotein2237% helix, 55% strand—
CFluorescent protein cyofpprotein2226% helix, 56% strand—
DFluorescent protein cyofpprotein2206% helix, 57% strand—

Ligands and binding sites

  • NRQ · {(4Z)-4-(4-hydroxybenzylidene)-2-[3-(methylthio) propanimidoyl]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid · ligand · 4 copies · chains A, B, C, D

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110910.830.85103empty
21220.790.9729NRQ
3930.760.9725NRQ
4920.760.9825NRQ
5890.740.9727NRQ

Interfaces

6 interfaces between chains.

  • A–B · 1458 Ų buried · 19 hydrogen bonds · protein-protein
  • C–D · 1307 Ų buried · 17 hydrogen bonds · protein-protein
  • A–D · 867 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 793 Ų buried · 4 hydrogen bonds · protein-protein
  • B–D · 52 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 8 cofactor (chromophore).

Compared structures

  • 5BQL · Fluorescent protein cyOFP · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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