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MolNFT v1 · #18934 · protein

S65T Q80R T203C green fluorescent protein (GFP) pH 5.5

1Q4D: “S65T Q80R T203C green fluorescent protein (GFP) pH 5.5”. X-ray diffraction, 1 ligand (CRO), 2 pockets (best druggability 0.77). MolNFT v1 #18934 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1Q4D
Type
protein
Length
225 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Green fluorescent protein
UniProt
P42212
Ligands
CRO
Pockets
2 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 12% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGreen fluorescent proteinprotein22512% helix, 52% strandP42212

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

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
11000.770.9732CRO
2750.360.7713empty

Modifications

Observed in the structure: 2 cofactor (chromophore).

Compared structures

  • 1Q4D · S65T Q80R T203C Green Fluorescent Protein (GFP) pH 5.5 · 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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