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MolNFT v1 · #134415 · protein

Cyan fluorescence protein soaked with selenourea for 5 min

5T3I · Green fluorescent protein: “Cyan fluorescence protein soaked with selenourea for 5 min”. X-ray diffraction, 3 ligands (SEY, CRF, PO4), 2 pockets (best druggability 0.78). MolNFT v1 #134415 on GenesisL1: 3D structure, binding sites…

PDB
5T3I
Type
protein
Length
228 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Green fluorescent protein
UniProt
P42212
Ligands
SEY, CRF, PO4
Pockets
2 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 12% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGreen fluorescent proteinprotein22812% helix, 51% strandP42212

Ligands and binding sites

  • SEY · selenourea · ligand · 13 copies · chains A
  • CRF · [(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(1H-indol-3-ylmethylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid · ligand · chains A
  • PO4 · Phosphate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11220.780.9628CRF
2640.350.7714empty

Modifications

Observed in the structure: 2 covalent (covalent ligand).

Compared structures

  • 5T3I · cyan fluorescence protein soaked with selenourea for 5 min · 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 0.98

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