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Yeast cytosine deaminase D92E triple mutant bound to transition state analogue hpy

Analyse Yeast cytosine deaminase D92E triple mutant bound to transition state analogue… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2O3K
Type
protein
Length
307 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cytosine deaminase
EC
3.5.4.1
UniProt
Q12178
Ligands
HPY, ZN, CA

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACytosine deaminase (EC 3.5.4.1)protein15446% helix, 16% strandQ12178
BCytosine deaminase (EC 3.5.4.1)protein15346% helix, 19% strandQ12178

Ligands and binding sites

  • HPY · 4-hydroxy-3,4-dihydro-1H-pyrimidin-2-one · ligand · 2 copies · chains A, B
  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • CA · Calcium ion · metal · chains A, B

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

Interfaces

1 interface between chains.

  • A–B · 1562 Ų buried · 26 hydrogen bonds · protein-protein

Compared structures

  • 2O3K · Yeast Cytosine Deaminase D92E Triple Mutant bound to transition state analogue HPY · the same entry in another collection · chain A against A, TM-score 1.00
  • Q12178 · AlphaFold monomer V2.0 prediction for cytosine deaminase (Q12178) · a predicted model of the same protein · chain A against A, TM-score 1.00

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