Marc C. Deller, D.Phil.
marcdeller.com eloratherapeutics.com marc@marcdeller.com GitHub DOI 10.5281/zenodo.21807353 
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PETase ANnotation and Triage System

Nature's solution to a human-made problem, and structural learnings from Nature

PANTS-bae249be37c1

Compost 139 aa · assembly ERZ10545954_FASTA_predicted_cds · contig ERZ10545954.23571-NODE-23573-length-1451-cov-3.555158_3

Retrieval

E-value9.70e-09
Bitscore22.4
Identity to nearest0.296
Nearest characterisedEC:A0ABW2Y2K9

Structure

Methodesmfold
Mean pLDDT75.3
RMSD to IsPETase14.95 Å
Aligned fraction0.125

Aligned fraction is a length-normalised gemmi superposition statistic, not a true TM-score.

Active site

TriadSNone/DNone/HNone
Ser–HisNone Å
His–AspNone Å
Cleft widthNone Å
Cleft depthNone Å

Aromatic clamp:

Structure, superposed on IsPETase

Catalytic triad drawn as ball-and-stick from the measured residues.

Sequence

GLKRGVHTPEAFAWARRLGVLRDQVDAETYALLGRSLADMDATAYLATLDRLAEHDATDVLRTVDVPTLVIAGDRDPFTSRASMEQLVSDVAGAEYLLLAGTSHFAPVDHAERVNLRIEKFWNERGYRGESLIPPAPGA