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MolNFT v1 · #64635 · protein

Green fluorescent protein bound to minimizer nanobody

3G9A: “Green fluorescent protein bound to minimizer nanobody”. X-ray diffraction, 1 ligand (GYS), 1 pocket (best druggability 0.75). MolNFT v1 #64635 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3G9A
Type
protein
Length
355 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Green fluorescent protein; Minimizer
UniProt
P42212
Ligands
GYS
Pockets
1 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 10% helix, 50% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGreen fluorescent proteinprotein22612% helix, 52% strandP42212
BMinimizerprotein1297% helix, 48% strand—

Ligands and binding sites

  • GYS · [(4Z)-2-(1-amino-2-hydroxyethyl)-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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1830.750.9823GYS

Interfaces

1 interface between chains.

  • A–B · 690 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 cofactor, 2 disulfide (chromophore, disulfide).

Compared structures

  • 3G9A · Green fluorescent protein bound to minimizer nanobody · 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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