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PreprintCC BYbioRxiv

N-Zinclopedia: A database of predicted transition metal-binding sites and metalloenzymes

  1. 1Tel Aviv University

Abstract

Metal ions are among the most common enzymatic cofactors, yet metal utilization remains poorly mapped. Here, we present N-Zinclopedia, an atlas of predicted transition metal-binding sites and candidate metalloenzymes across protein fold space. N-Zinclopedia catalogs protein sites compatible with transition metal coordination, identified using ZincSight screening of protein structure model databases. We focused on previously uncharacterized domains and proteins, screening for transition metal-binding sites within over a million of these, spanning both poorly annotated and canonical folds. We also classified the predicted sites, using MAHOMES-II, as candidate catalytic or non-catalytic metal-binding sites. Experimental characterization of a previously unknown zinc binding site confirms that ZincSight can determine previously un-annotated zinc binding. N-Zinclopedia significantly expands the known landscape of metal utilization, providing numerous predictions that await experimental examination. N-Zinclopedia is available at: https://bentallab.github.io/nzinclopedia.

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BibTeX
@misc{mechtinger2026nzinclopedia,
  title = {{N-Zinclopedia: A database of predicted transition metal-binding sites and metalloenzymes}},
  author = {G. Mechtinger and G. Axel and L. Marcellino and A. M. Bowman and J. Slusky and N. Ben-Tal},
  howpublished = {bioRxiv},
  year = {2026},
  month = oct,
  doi = {10.64898/2026.10.18.759936},
  url = {https://www.biorxiv.org/content/10.64898/2026.10.18.759936v1},
  note = {CC BY},
}
RIS
TY  - UNPB
TI  - N-Zinclopedia: A database of predicted transition metal-binding sites and metalloenzymes
AU  - G. Mechtinger
AU  - G. Axel
AU  - L. Marcellino
AU  - A. M. Bowman
AU  - J. Slusky
AU  - N. Ben-Tal
PY  - 2026
DA  - 2026/10/18
PB  - bioRxiv
DO  - 10.64898/2026.10.18.759936
UR  - https://www.biorxiv.org/content/10.64898/2026.10.18.759936v1
AB  - Metal ions are among the most common enzymatic cofactors, yet metal utilization remains poorly mapped. Here, we present N-Zinclopedia, an atlas of predicted transition metal-binding sites and candidate metalloenzymes across protein fold space. N-Zinclopedia catalogs protein sites compatible with transition metal coordination, identified using ZincSight screening of protein structure model databases. We focused on previously uncharacterized domains and proteins, screening for transition metal-binding sites within over a million of these, spanning both poorly annotated and canonical folds. We also classified the predicted sites, using MAHOMES-II, as candidate catalytic or non-catalytic metal-binding sites. Experimental characterization of a previously unknown zinc binding site confirms that ZincSight can determine previously un-annotated zinc binding. N-Zinclopedia significantly expands the known landscape of metal utilization, providing numerous predictions that await experimental examination. N-Zinclopedia is available at: https://bentallab.github.io/nzinclopedia.
ER  -