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MolNFT v1 · #23108 · protein

Crystal structure of yhhw from escherichia COLI

1TQ5 · Protein yhhw: “Crystal structure of yhhw from escherichia COLI”. X-ray diffraction, 1 ligand (CD), 1 pocket (best druggability 0.46). MolNFT v1 #23108 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1TQ5
Type
protein
Length
234 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein yhhw
UniProt
P46852
Ligands
CD
Pockets
1 · best druggability 0.46

Structure

x-ray diffraction · 1 distinct chain · 3% helix, 55% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein yhhwprotein2343% helix, 55% strandP46852

Ligands and binding sites

  • CD · Cadmium ion · metal · 6 copies · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1990.460.7918CD

Modifications

Observed in the structure: 7 modified (engineered).

Compared structures

  • 1TQ5 · Crystal Structure of YhhW from Escherichia coli · the same entry in another collection · chain A against A, TM-score 1.00
  • P46852 · AlphaFold monomer V2.0 prediction for quercetin 2,3-dioxygenase (P46852) · a predicted model of the same protein · chain A against A, TM-score 0.98

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