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PETase ANnotation and Triage System

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

PANTS-a6bb2d5e105e

Human gut 274 aa · assembly ERZ4239610_FASTA_predicted_cds · contig ERZ4239610.1483-NODE-1483-length-7959-cov-4.312627_9

Retrieval

E-value9.00e-12
Bitscore32.3
Identity to nearest0.315
Nearest characterisedEC:A0A2P4UDP6

Structure

Methodesmfold
Mean pLDDT89.4
RMSD to IsPETase17.63 Å
Aligned fraction0.219

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

Active site

TriadS157/D205/H237
Ser–His2.96 Å
His–Asp2.92 Å
Cleft width21.31 Å
Cleft depth3.78 Å

Aromatic clamp: PHE101, PHE117, PHE200, PHE242, PHE244, PHE64, TRP108, TRP240, TRP68, TYR164

Structure, superposed on IsPETase

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

Sequence

MNRIVTILLLIFAALPLSVAAQSRDLNQAYKKEVFTDGRHKKMPYRLLSPKIRADHSQYPLVVFLHGWGERGDDNEKQLTNGASLFTNPANEDAYPAFVLFPQTRKTWTGNIDPRSFQHGAPEPKETQTEKTLMELINKVVAENPIDRSRIYLVGLSMGGIATYDLVCRYPDVFAAAVPICGAVNPDRLKNAKGVNFLIFHGDQDEEVPTVASREAFKTLDAIGATVKYVEFAGVGHECWSFAFNSPTFLSWLFQQEKTPAHSESIAAIPSHEE