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Crystallographic evidence for isomeric chromophores in 3- fluorotyrosyl-green fluorescent protein

Analyse Crystallographic evidence for isomeric chromophores in 3- fluorotyrosyl-green… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1RRX
Type
protein
Length
225 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SIGF1-GFP fusion protein
UniProt
P42212
Ligands
MFC
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASIGF1-GFP fusion proteinprotein22510% helix, 52% strandP42212

Ligands and binding sites

  • MFC · 5-[1-(3-fluoro-4-hydroxy-phenyl)-meth-(Z)-ylidene]-3,5-dihydro-imidazol-4-one · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11080.780.9728MFC

Modifications

Observed in the structure: 9 modified, 2 covalent (nonstandard, covalent ligand).

Compared structures

  • 1RRX · Crystallographic Evidence for Isomeric Chromophores in 3-Fluorotyrosyl-Green Fluorescent… · 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 1.00

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