Observing a ring-cleaving dioxygenase in action through a crystalline lens - an enol tautomer of acms monodentately bound structure

Structure

x-ray diffraction · 1 distinct chain · 15% helix, 38% strand (DSSP).

Ligands and binding sites

• 2FO · (2Z,3Z)-2-[(2Z)-3-hydroxyprop-2-en-1-ylidene]-3-iminobutanedioic acid · ligand · chains A
• FE2 · Fe (II) ion · metal · 2 copies · chains A
• TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 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.

Compared structures

• 6X11 · Observing a ring-cleaving dioxygenase in action through a crystalline lens - an enol… · the same entry in another collection · chain A against A, TM-score 1.00
• Q1LCS4 · AlphaFold monomer V2.0 prediction for 3-hydroxyanthranilate 3,4-dioxygenase (Q1LCS4) · a predicted model of the same protein · chain A against A, TM-score 0.99

Analyse

• Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
• Every structure of UniProt Q1LCS4
• Elsewhere: RCSB PDB 6X11 · PDBe 6X11 · UniProt Q1LCS4